USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 872 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 SER OG : rot -113:sc= 0.714 USER MOD Set 1.2: A 88 ASN : amide:sc= 1.03 K(o=1.7,f=-3.9!) USER MOD Set 2.1: A 51 THR OG1 : rot 180:sc= -0.159 USER MOD Set 2.2: A 82 GLN : amide:sc= -0.153 X(o=-0.31,f=0) USER MOD Set 3.1: A 26 GLN : amide:sc= -0.22 K(o=-0.25,f=-1.1) USER MOD Set 3.2: A 63 GLN : amide:sc= -0.0332 K(o=-0.25,f=-2.1!) USER MOD Single : A 1 MET CE :methyl 140:sc= -0.143 (180deg=-1.07) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -2.96! C(o=-3!,f=-6.8!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -163:sc= -0.0505 (180deg=-0.552) USER MOD Single : A 14 ASN :FLIP amide:sc= -0.325 F(o=-1.6,f=-0.33) USER MOD Single : A 16 GLN : amide:sc=-0.00491 K(o=-0.0049,f=-1.5!) USER MOD Single : A 19 ASN :FLIP amide:sc= -4.56! C(o=-8.3!,f=-4.6!) USER MOD Single : A 21 LYS NZ :NH3+ 158:sc= -0.325 (180deg=-0.913) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN :FLIP amide:sc= -7.88! C(o=-9.5!,f=-7.9!) USER MOD Single : A 31 THR OG1 : rot 67:sc= 1.1 USER MOD Single : A 32 HIS : no HD1:sc= -0.0201 X(o=-0.02,f=-0.00048) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= -1.2 USER MOD Single : A 37 GLN : amide:sc= -0.352 K(o=-0.35,f=-2.2!) USER MOD Single : A 45 THR OG1 : rot -140:sc= -0.161 USER MOD Single : A 49 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.112) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 175:sc= 0.272 USER MOD Single : A 67 TYR OH : rot 70:sc= 0.455 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -10.9! C(o=-11!,f=-25!) USER MOD Single : A 84 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 86 ASN : amide:sc= 0.195 K(o=0.19,f=-8.1!) USER MOD Single : A 87 LYS NZ :NH3+ 161:sc= -0.0336 (180deg=-0.455) USER MOD Single : A 89 SER OG : rot -55:sc= 0.286 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 104 HIS : no HD1:sc= -0.0505 X(o=-0.051,f=-0.046) USER MOD Single : A 105 HIS : no HD1:sc= -0.188 X(o=-0.19,f=-0.12) USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=-0.0081) USER MOD Single : A 107 HIS : no HE2:sc= -0.343 K(o=-0.34,f=-5.8!) USER MOD Single : A 108 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 109 HIS : no HD1:sc= -1.91! C(o=-1.9!,f=-4.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.387 3.986 -13.374 1.00 0.00 N ATOM 2 CA MET A 1 -16.158 3.234 -12.110 1.00 0.00 C ATOM 3 C MET A 1 -14.709 3.448 -11.668 1.00 0.00 C ATOM 4 O MET A 1 -13.843 2.620 -11.886 1.00 0.00 O ATOM 5 CB MET A 1 -16.435 1.744 -12.342 1.00 0.00 C ATOM 6 CG MET A 1 -16.303 0.980 -11.024 1.00 0.00 C ATOM 7 SD MET A 1 -16.747 -0.756 -11.287 1.00 0.00 S ATOM 8 CE MET A 1 -15.369 -1.195 -12.376 1.00 0.00 C ATOM 0 H1 MET A 1 -17.370 3.849 -13.686 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.213 4.998 -13.212 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.739 3.637 -14.108 1.00 0.00 H new ATOM 0 HA MET A 1 -16.830 3.592 -11.330 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.436 1.611 -12.751 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.735 1.345 -13.076 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.282 1.053 -10.650 1.00 0.00 H new ATOM 0 HG3 MET A 1 -16.952 1.422 -10.268 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.007 -2.191 -12.121 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.707 -1.186 -13.412 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.562 -0.472 -12.252 1.00 0.00 H new ATOM 20 N GLU A 2 -14.442 4.574 -11.061 1.00 0.00 N ATOM 21 CA GLU A 2 -13.056 4.885 -10.608 1.00 0.00 C ATOM 22 C GLU A 2 -12.826 4.291 -9.211 1.00 0.00 C ATOM 23 O GLU A 2 -13.748 4.164 -8.432 1.00 0.00 O ATOM 24 CB GLU A 2 -12.883 6.406 -10.545 1.00 0.00 C ATOM 25 CG GLU A 2 -12.724 6.960 -11.962 1.00 0.00 C ATOM 26 CD GLU A 2 -12.561 8.481 -11.906 1.00 0.00 C ATOM 27 OE1 GLU A 2 -13.328 9.114 -11.200 1.00 0.00 O ATOM 28 OE2 GLU A 2 -11.674 8.985 -12.574 1.00 0.00 O ATOM 0 H GLU A 2 -15.132 5.298 -10.858 1.00 0.00 H new ATOM 0 HA GLU A 2 -12.337 4.457 -11.306 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -13.746 6.861 -10.060 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -12.010 6.659 -9.944 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -11.856 6.509 -12.444 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -13.594 6.700 -12.564 1.00 0.00 H new ATOM 35 N PRO A 3 -11.604 3.938 -8.890 1.00 0.00 N ATOM 36 CA PRO A 3 -11.265 3.357 -7.559 1.00 0.00 C ATOM 37 C PRO A 3 -11.458 4.365 -6.418 1.00 0.00 C ATOM 38 O PRO A 3 -11.296 5.559 -6.585 1.00 0.00 O ATOM 39 CB PRO A 3 -9.789 2.941 -7.699 1.00 0.00 C ATOM 40 CG PRO A 3 -9.248 3.789 -8.805 1.00 0.00 C ATOM 41 CD PRO A 3 -10.418 4.049 -9.754 1.00 0.00 C ATOM 0 HA PRO A 3 -11.916 2.522 -7.301 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -9.243 3.108 -6.771 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -9.699 1.881 -7.935 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -8.846 4.725 -8.417 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -8.433 3.282 -9.321 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -10.349 5.035 -10.213 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.444 3.321 -10.565 1.00 0.00 H new ATOM 49 N GLN A 4 -11.810 3.886 -5.261 1.00 0.00 N ATOM 50 CA GLN A 4 -12.022 4.800 -4.109 1.00 0.00 C ATOM 51 C GLN A 4 -10.667 5.193 -3.518 1.00 0.00 C ATOM 52 O GLN A 4 -10.150 4.552 -2.623 1.00 0.00 O ATOM 53 CB GLN A 4 -12.866 4.084 -3.054 1.00 0.00 C ATOM 54 CG GLN A 4 -14.270 3.816 -3.614 1.00 0.00 C ATOM 55 CD GLN A 4 -14.235 2.605 -4.552 1.00 0.00 C ATOM 56 OE1 GLN A 4 -13.878 2.726 -5.709 1.00 0.00 O ATOM 57 NE2 GLN A 4 -14.595 1.435 -4.100 1.00 0.00 N ATOM 0 H GLN A 4 -11.961 2.897 -5.063 1.00 0.00 H new ATOM 0 HA GLN A 4 -12.541 5.701 -4.437 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -12.391 3.145 -2.770 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -12.933 4.693 -2.152 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -14.968 3.634 -2.797 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -14.630 4.693 -4.152 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -14.894 1.333 -3.130 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -14.577 0.623 -4.716 1.00 0.00 H new ATOM 66 N LEU A 5 -10.094 6.250 -4.022 1.00 0.00 N ATOM 67 CA LEU A 5 -8.772 6.706 -3.514 1.00 0.00 C ATOM 68 C LEU A 5 -8.945 7.385 -2.162 1.00 0.00 C ATOM 69 O LEU A 5 -9.971 7.969 -1.865 1.00 0.00 O ATOM 70 CB LEU A 5 -8.155 7.697 -4.503 1.00 0.00 C ATOM 71 CG LEU A 5 -8.039 7.043 -5.885 1.00 0.00 C ATOM 72 CD1 LEU A 5 -7.448 8.051 -6.877 1.00 0.00 C ATOM 73 CD2 LEU A 5 -7.130 5.804 -5.804 1.00 0.00 C ATOM 0 H LEU A 5 -10.488 6.821 -4.769 1.00 0.00 H new ATOM 0 HA LEU A 5 -8.115 5.843 -3.404 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -8.770 8.594 -4.565 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -7.171 8.009 -4.154 1.00 0.00 H new ATOM 0 HG LEU A 5 -9.029 6.736 -6.222 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -7.365 7.588 -7.860 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.099 8.923 -6.941 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -6.460 8.360 -6.537 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.052 5.345 -6.789 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -6.138 6.102 -5.463 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -7.555 5.087 -5.102 1.00 0.00 H new ATOM 85 N THR A 6 -7.937 7.314 -1.338 1.00 0.00 N ATOM 86 CA THR A 6 -8.014 7.950 0.004 1.00 0.00 C ATOM 87 C THR A 6 -6.643 8.507 0.385 1.00 0.00 C ATOM 88 O THR A 6 -5.617 8.076 -0.108 1.00 0.00 O ATOM 89 CB THR A 6 -8.468 6.918 1.043 1.00 0.00 C ATOM 90 OG1 THR A 6 -8.935 7.598 2.199 1.00 0.00 O ATOM 91 CG2 THR A 6 -7.306 5.990 1.421 1.00 0.00 C ATOM 0 H THR A 6 -7.057 6.839 -1.540 1.00 0.00 H new ATOM 0 HA THR A 6 -8.737 8.765 -0.023 1.00 0.00 H new ATOM 0 HB THR A 6 -9.270 6.313 0.620 1.00 0.00 H new ATOM 0 HG1 THR A 6 -9.229 6.944 2.867 1.00 0.00 H new ATOM 0 HG21 THR A 6 -7.646 5.264 2.159 1.00 0.00 H new ATOM 0 HG22 THR A 6 -6.955 5.466 0.532 1.00 0.00 H new ATOM 0 HG23 THR A 6 -6.491 6.580 1.841 1.00 0.00 H new ATOM 99 N LYS A 7 -6.628 9.467 1.261 1.00 0.00 N ATOM 100 CA LYS A 7 -5.346 10.084 1.695 1.00 0.00 C ATOM 101 C LYS A 7 -4.877 9.465 3.010 1.00 0.00 C ATOM 102 O LYS A 7 -5.645 8.893 3.761 1.00 0.00 O ATOM 103 CB LYS A 7 -5.564 11.583 1.887 1.00 0.00 C ATOM 104 CG LYS A 7 -5.943 12.236 0.537 1.00 0.00 C ATOM 105 CD LYS A 7 -7.466 12.338 0.410 1.00 0.00 C ATOM 106 CE LYS A 7 -7.825 12.842 -0.984 1.00 0.00 C ATOM 107 NZ LYS A 7 -7.212 14.182 -1.192 1.00 0.00 N ATOM 0 H LYS A 7 -7.461 9.857 1.702 1.00 0.00 H new ATOM 0 HA LYS A 7 -4.584 9.907 0.936 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -6.354 11.754 2.618 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -4.659 12.043 2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -5.497 13.228 0.466 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.540 11.646 -0.287 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -7.923 11.364 0.585 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -7.861 13.016 1.167 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -7.466 12.143 -1.740 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -8.908 12.903 -1.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -7.673 14.653 -1.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -7.337 14.758 -0.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -6.197 14.072 -1.390 1.00 0.00 H new ATOM 121 N ILE A 8 -3.612 9.589 3.285 1.00 0.00 N ATOM 122 CA ILE A 8 -3.050 9.026 4.540 1.00 0.00 C ATOM 123 C ILE A 8 -3.695 9.724 5.740 1.00 0.00 C ATOM 124 O ILE A 8 -4.054 9.101 6.721 1.00 0.00 O ATOM 125 CB ILE A 8 -1.541 9.266 4.553 1.00 0.00 C ATOM 126 CG1 ILE A 8 -0.889 8.433 3.444 1.00 0.00 C ATOM 127 CG2 ILE A 8 -0.969 8.852 5.911 1.00 0.00 C ATOM 128 CD1 ILE A 8 0.583 8.828 3.286 1.00 0.00 C ATOM 0 H ILE A 8 -2.935 10.062 2.686 1.00 0.00 H new ATOM 0 HA ILE A 8 -3.253 7.956 4.596 1.00 0.00 H new ATOM 0 HB ILE A 8 -1.336 10.323 4.384 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -0.965 7.372 3.682 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -1.418 8.587 2.504 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.107 9.023 5.920 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -1.437 9.443 6.698 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -1.170 7.795 6.083 1.00 0.00 H new ATOM 0 HD11 ILE A 8 1.037 8.230 2.496 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.650 9.884 3.026 1.00 0.00 H new ATOM 0 HD13 ILE A 8 1.110 8.650 4.223 1.00 0.00 H new ATOM 140 N VAL A 9 -3.844 11.016 5.665 1.00 0.00 N ATOM 141 CA VAL A 9 -4.467 11.765 6.794 1.00 0.00 C ATOM 142 C VAL A 9 -5.911 11.287 6.982 1.00 0.00 C ATOM 143 O VAL A 9 -6.456 11.323 8.069 1.00 0.00 O ATOM 144 CB VAL A 9 -4.454 13.262 6.473 1.00 0.00 C ATOM 145 CG1 VAL A 9 -5.338 13.540 5.252 1.00 0.00 C ATOM 146 CG2 VAL A 9 -4.986 14.051 7.671 1.00 0.00 C ATOM 0 H VAL A 9 -3.561 11.588 4.869 1.00 0.00 H new ATOM 0 HA VAL A 9 -3.906 11.587 7.712 1.00 0.00 H new ATOM 0 HB VAL A 9 -3.431 13.570 6.258 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.325 14.607 5.029 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.959 12.985 4.394 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -6.360 13.226 5.464 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.975 15.116 7.439 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.007 13.737 7.889 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.355 13.863 8.540 1.00 0.00 H new ATOM 156 N ASP A 10 -6.532 10.833 5.929 1.00 0.00 N ATOM 157 CA ASP A 10 -7.936 10.344 6.039 1.00 0.00 C ATOM 158 C ASP A 10 -7.936 8.965 6.702 1.00 0.00 C ATOM 159 O ASP A 10 -8.945 8.494 7.194 1.00 0.00 O ATOM 160 CB ASP A 10 -8.537 10.231 4.637 1.00 0.00 C ATOM 161 CG ASP A 10 -8.743 11.630 4.052 1.00 0.00 C ATOM 162 OD1 ASP A 10 -8.676 12.583 4.809 1.00 0.00 O ATOM 163 OD2 ASP A 10 -8.962 11.723 2.854 1.00 0.00 O ATOM 0 H ASP A 10 -6.127 10.779 4.994 1.00 0.00 H new ATOM 0 HA ASP A 10 -8.525 11.039 6.637 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -7.877 9.650 3.993 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -9.488 9.700 4.680 1.00 0.00 H new ATOM 168 N ILE A 11 -6.806 8.309 6.720 1.00 0.00 N ATOM 169 CA ILE A 11 -6.735 6.959 7.349 1.00 0.00 C ATOM 170 C ILE A 11 -6.463 7.103 8.847 1.00 0.00 C ATOM 171 O ILE A 11 -5.409 7.539 9.267 1.00 0.00 O ATOM 172 CB ILE A 11 -5.612 6.148 6.694 1.00 0.00 C ATOM 173 CG1 ILE A 11 -5.977 5.869 5.230 1.00 0.00 C ATOM 174 CG2 ILE A 11 -5.427 4.821 7.436 1.00 0.00 C ATOM 175 CD1 ILE A 11 -4.789 5.234 4.502 1.00 0.00 C ATOM 0 H ILE A 11 -5.929 8.650 6.326 1.00 0.00 H new ATOM 0 HA ILE A 11 -7.684 6.442 7.206 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.683 6.716 6.740 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.840 5.204 5.183 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.262 6.797 4.735 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.627 4.249 6.965 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.168 5.019 8.476 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.354 4.249 7.395 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.060 5.040 3.464 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -3.937 5.913 4.534 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.523 4.296 4.989 1.00 0.00 H new ATOM 187 N VAL A 12 -7.416 6.731 9.651 1.00 0.00 N ATOM 188 CA VAL A 12 -7.248 6.826 11.128 1.00 0.00 C ATOM 189 C VAL A 12 -8.151 5.785 11.786 1.00 0.00 C ATOM 190 O VAL A 12 -8.444 5.857 12.964 1.00 0.00 O ATOM 191 CB VAL A 12 -7.634 8.232 11.610 1.00 0.00 C ATOM 192 CG1 VAL A 12 -6.622 9.250 11.078 1.00 0.00 C ATOM 193 CG2 VAL A 12 -9.035 8.596 11.101 1.00 0.00 C ATOM 0 H VAL A 12 -8.316 6.360 9.345 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.208 6.641 11.397 1.00 0.00 H new ATOM 0 HB VAL A 12 -7.633 8.247 12.700 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -6.896 10.248 11.420 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -5.627 9.000 11.446 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.622 9.227 9.988 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -9.300 9.595 11.448 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.043 8.576 10.011 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.759 7.876 11.482 1.00 0.00 H new ATOM 203 N GLU A 13 -8.602 4.815 11.024 1.00 0.00 N ATOM 204 CA GLU A 13 -9.501 3.754 11.583 1.00 0.00 C ATOM 205 C GLU A 13 -8.932 2.369 11.265 1.00 0.00 C ATOM 206 O GLU A 13 -8.456 2.111 10.176 1.00 0.00 O ATOM 207 CB GLU A 13 -10.893 3.892 10.963 1.00 0.00 C ATOM 208 CG GLU A 13 -11.545 5.178 11.474 1.00 0.00 C ATOM 209 CD GLU A 13 -12.919 5.350 10.823 1.00 0.00 C ATOM 210 OE1 GLU A 13 -13.291 4.493 10.039 1.00 0.00 O ATOM 211 OE2 GLU A 13 -13.574 6.333 11.122 1.00 0.00 O ATOM 0 H GLU A 13 -8.384 4.713 10.033 1.00 0.00 H new ATOM 0 HA GLU A 13 -9.569 3.871 12.665 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -10.819 3.914 9.876 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -11.507 3.030 11.223 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -11.647 5.140 12.559 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -10.912 6.035 11.244 1.00 0.00 H new ATOM 218 N ASN A 14 -8.970 1.479 12.222 1.00 0.00 N ATOM 219 CA ASN A 14 -8.426 0.113 12.013 1.00 0.00 C ATOM 220 C ASN A 14 -9.404 -0.748 11.206 1.00 0.00 C ATOM 221 O ASN A 14 -10.604 -0.727 11.418 1.00 0.00 O ATOM 222 CB ASN A 14 -8.192 -0.531 13.378 1.00 0.00 C ATOM 223 CG ASN A 14 -6.957 0.084 14.043 1.00 0.00 C ATOM 224 OD1 ASN A 14 -5.919 0.393 13.314 1.00 0.00 O flip ATOM 225 ND2 ASN A 14 -6.933 0.276 15.244 1.00 0.00 N flip ATOM 0 H ASN A 14 -9.360 1.647 13.149 1.00 0.00 H new ATOM 0 HA ASN A 14 -7.492 0.183 11.456 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -9.067 -0.386 14.012 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.056 -1.606 13.263 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -7.743 0.035 15.815 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -6.103 0.678 15.680 1.00 0.00 H new ATOM 232 N GLY A 15 -8.882 -1.519 10.288 1.00 0.00 N ATOM 233 CA GLY A 15 -9.743 -2.408 9.454 1.00 0.00 C ATOM 234 C GLY A 15 -10.406 -1.597 8.337 1.00 0.00 C ATOM 235 O GLY A 15 -11.304 -2.069 7.663 1.00 0.00 O ATOM 0 H GLY A 15 -7.885 -1.571 10.079 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -9.143 -3.211 9.025 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -10.505 -2.877 10.076 1.00 0.00 H new ATOM 239 N GLN A 16 -9.981 -0.382 8.134 1.00 0.00 N ATOM 240 CA GLN A 16 -10.600 0.451 7.063 1.00 0.00 C ATOM 241 C GLN A 16 -10.198 -0.083 5.687 1.00 0.00 C ATOM 242 O GLN A 16 -9.039 -0.333 5.409 1.00 0.00 O ATOM 243 CB GLN A 16 -10.148 1.903 7.211 1.00 0.00 C ATOM 244 CG GLN A 16 -10.791 2.759 6.115 1.00 0.00 C ATOM 245 CD GLN A 16 -10.519 4.240 6.395 1.00 0.00 C ATOM 246 OE1 GLN A 16 -10.812 4.732 7.468 1.00 0.00 O ATOM 247 NE2 GLN A 16 -9.968 4.977 5.469 1.00 0.00 N ATOM 0 H GLN A 16 -9.234 0.071 8.661 1.00 0.00 H new ATOM 0 HA GLN A 16 -11.685 0.403 7.157 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -10.428 2.283 8.194 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -9.062 1.964 7.143 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -10.388 2.483 5.140 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -11.865 2.576 6.080 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -9.722 4.565 4.569 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -9.784 5.965 5.646 1.00 0.00 H new ATOM 256 N TRP A 17 -11.167 -0.267 4.827 1.00 0.00 N ATOM 257 CA TRP A 17 -10.887 -0.794 3.460 1.00 0.00 C ATOM 258 C TRP A 17 -10.980 0.339 2.444 1.00 0.00 C ATOM 259 O TRP A 17 -11.935 1.091 2.422 1.00 0.00 O ATOM 260 CB TRP A 17 -11.928 -1.861 3.121 1.00 0.00 C ATOM 261 CG TRP A 17 -11.646 -3.095 3.917 1.00 0.00 C ATOM 262 CD1 TRP A 17 -12.128 -3.346 5.156 1.00 0.00 C ATOM 263 CD2 TRP A 17 -10.828 -4.243 3.555 1.00 0.00 C ATOM 264 NE1 TRP A 17 -11.656 -4.576 5.578 1.00 0.00 N ATOM 265 CE2 TRP A 17 -10.852 -5.168 4.625 1.00 0.00 C ATOM 266 CE3 TRP A 17 -10.076 -4.569 2.412 1.00 0.00 C ATOM 267 CZ2 TRP A 17 -10.154 -6.375 4.563 1.00 0.00 C ATOM 268 CZ3 TRP A 17 -9.372 -5.783 2.347 1.00 0.00 C ATOM 269 CH2 TRP A 17 -9.411 -6.683 3.421 1.00 0.00 C ATOM 0 H TRP A 17 -12.150 -0.072 5.017 1.00 0.00 H new ATOM 0 HA TRP A 17 -9.886 -1.223 3.429 1.00 0.00 H new ATOM 0 HB2 TRP A 17 -12.929 -1.492 3.343 1.00 0.00 H new ATOM 0 HB3 TRP A 17 -11.900 -2.087 2.055 1.00 0.00 H new ATOM 0 HD1 TRP A 17 -12.775 -2.693 5.723 1.00 0.00 H new ATOM 0 HE1 TRP A 17 -11.875 -4.994 6.482 1.00 0.00 H new ATOM 0 HE3 TRP A 17 -10.040 -3.882 1.579 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 -10.188 -7.066 5.392 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 -8.798 -6.024 1.465 1.00 0.00 H new ATOM 0 HH2 TRP A 17 -8.867 -7.614 3.365 1.00 0.00 H new ATOM 280 N ALA A 18 -9.996 0.461 1.594 1.00 0.00 N ATOM 281 CA ALA A 18 -10.031 1.545 0.567 1.00 0.00 C ATOM 282 C ALA A 18 -8.789 1.458 -0.323 1.00 0.00 C ATOM 283 O ALA A 18 -7.918 0.629 -0.123 1.00 0.00 O ATOM 284 CB ALA A 18 -10.066 2.919 1.247 1.00 0.00 C ATOM 0 H ALA A 18 -9.172 -0.140 1.565 1.00 0.00 H new ATOM 0 HA ALA A 18 -10.928 1.420 -0.040 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -10.091 3.700 0.487 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -10.955 2.993 1.873 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -9.176 3.042 1.865 1.00 0.00 H new ATOM 290 N ASN A 19 -8.709 2.313 -1.311 1.00 0.00 N ATOM 291 CA ASN A 19 -7.537 2.307 -2.241 1.00 0.00 C ATOM 292 C ASN A 19 -6.622 3.488 -1.919 1.00 0.00 C ATOM 293 O ASN A 19 -7.072 4.554 -1.545 1.00 0.00 O ATOM 294 CB ASN A 19 -8.026 2.453 -3.682 1.00 0.00 C ATOM 295 CG ASN A 19 -9.054 1.366 -3.997 1.00 0.00 C ATOM 296 OD1 ASN A 19 -9.280 0.418 -3.129 1.00 0.00 O flip ATOM 297 ND2 ASN A 19 -9.667 1.382 -5.047 1.00 0.00 N flip ATOM 0 H ASN A 19 -9.413 3.023 -1.516 1.00 0.00 H new ATOM 0 HA ASN A 19 -6.995 1.369 -2.122 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -8.470 3.438 -3.826 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -7.184 2.379 -4.370 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -9.493 2.121 -5.728 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -10.355 0.656 -5.247 1.00 0.00 H new ATOM 304 N LEU A 20 -5.337 3.308 -2.065 1.00 0.00 N ATOM 305 CA LEU A 20 -4.386 4.420 -1.774 1.00 0.00 C ATOM 306 C LEU A 20 -3.242 4.415 -2.784 1.00 0.00 C ATOM 307 O LEU A 20 -2.667 3.386 -3.087 1.00 0.00 O ATOM 308 CB LEU A 20 -3.813 4.250 -0.370 1.00 0.00 C ATOM 309 CG LEU A 20 -2.787 5.383 -0.076 1.00 0.00 C ATOM 310 CD1 LEU A 20 -2.987 5.917 1.344 1.00 0.00 C ATOM 311 CD2 LEU A 20 -1.350 4.848 -0.207 1.00 0.00 C ATOM 0 H LEU A 20 -4.904 2.438 -2.374 1.00 0.00 H new ATOM 0 HA LEU A 20 -4.923 5.366 -1.844 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.617 4.275 0.366 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -3.329 3.277 -0.280 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.946 6.185 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -2.264 6.709 1.540 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -3.997 6.314 1.444 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -2.842 5.108 2.061 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -0.643 5.651 0.001 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.198 4.036 0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.191 4.477 -1.220 1.00 0.00 H new ATOM 323 N LYS A 21 -2.904 5.570 -3.299 1.00 0.00 N ATOM 324 CA LYS A 21 -1.788 5.673 -4.290 1.00 0.00 C ATOM 325 C LYS A 21 -0.629 6.441 -3.663 1.00 0.00 C ATOM 326 O LYS A 21 -0.819 7.426 -2.976 1.00 0.00 O ATOM 327 CB LYS A 21 -2.272 6.413 -5.531 1.00 0.00 C ATOM 328 CG LYS A 21 -1.166 6.394 -6.589 1.00 0.00 C ATOM 329 CD LYS A 21 -1.707 6.933 -7.919 1.00 0.00 C ATOM 330 CE LYS A 21 -2.131 8.396 -7.765 1.00 0.00 C ATOM 331 NZ LYS A 21 -1.131 9.125 -6.938 1.00 0.00 N ATOM 0 H LYS A 21 -3.358 6.455 -3.073 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.458 4.673 -4.572 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -3.174 5.942 -5.922 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -2.533 7.441 -5.278 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -0.323 7.000 -6.257 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.795 5.378 -6.722 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.943 6.848 -8.692 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -2.557 6.333 -8.244 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.217 8.865 -8.745 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -3.114 8.452 -7.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.197 10.145 -7.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -1.322 8.952 -5.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.175 8.789 -7.172 1.00 0.00 H new ATOM 345 N ALA A 22 0.574 5.993 -3.887 1.00 0.00 N ATOM 346 CA ALA A 22 1.742 6.702 -3.288 1.00 0.00 C ATOM 347 C ALA A 22 3.021 6.325 -4.029 1.00 0.00 C ATOM 348 O ALA A 22 3.007 5.552 -4.968 1.00 0.00 O ATOM 349 CB ALA A 22 1.881 6.318 -1.818 1.00 0.00 C ATOM 0 H ALA A 22 0.800 5.175 -4.453 1.00 0.00 H new ATOM 0 HA ALA A 22 1.580 7.777 -3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 22 2.735 6.838 -1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 22 0.975 6.599 -1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 22 2.032 5.242 -1.736 1.00 0.00 H new ATOM 355 N LYS A 23 4.131 6.880 -3.607 1.00 0.00 N ATOM 356 CA LYS A 23 5.438 6.588 -4.271 1.00 0.00 C ATOM 357 C LYS A 23 6.372 5.867 -3.303 1.00 0.00 C ATOM 358 O LYS A 23 6.438 6.176 -2.128 1.00 0.00 O ATOM 359 CB LYS A 23 6.063 7.907 -4.719 1.00 0.00 C ATOM 360 CG LYS A 23 7.355 7.633 -5.488 1.00 0.00 C ATOM 361 CD LYS A 23 7.910 8.953 -6.023 1.00 0.00 C ATOM 362 CE LYS A 23 9.195 8.689 -6.808 1.00 0.00 C ATOM 363 NZ LYS A 23 9.698 9.968 -7.382 1.00 0.00 N ATOM 0 H LYS A 23 4.187 7.530 -2.823 1.00 0.00 H new ATOM 0 HA LYS A 23 5.276 5.943 -5.134 1.00 0.00 H new ATOM 0 HB2 LYS A 23 5.363 8.456 -5.349 1.00 0.00 H new ATOM 0 HB3 LYS A 23 6.271 8.534 -3.852 1.00 0.00 H new ATOM 0 HG2 LYS A 23 8.086 7.155 -4.836 1.00 0.00 H new ATOM 0 HG3 LYS A 23 7.164 6.945 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.173 9.436 -6.665 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.110 9.636 -5.198 1.00 0.00 H new ATOM 0 HE2 LYS A 23 9.949 8.250 -6.155 1.00 0.00 H new ATOM 0 HE3 LYS A 23 9.006 7.970 -7.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 10.572 9.789 -7.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 8.980 10.369 -8.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 9.894 10.640 -6.613 1.00 0.00 H new ATOM 377 N VAL A 24 7.089 4.890 -3.795 1.00 0.00 N ATOM 378 CA VAL A 24 8.015 4.122 -2.917 1.00 0.00 C ATOM 379 C VAL A 24 9.300 4.915 -2.668 1.00 0.00 C ATOM 380 O VAL A 24 9.952 5.381 -3.585 1.00 0.00 O ATOM 381 CB VAL A 24 8.356 2.795 -3.596 1.00 0.00 C ATOM 382 CG1 VAL A 24 9.419 2.052 -2.783 1.00 0.00 C ATOM 383 CG2 VAL A 24 7.090 1.934 -3.688 1.00 0.00 C ATOM 0 H VAL A 24 7.071 4.592 -4.770 1.00 0.00 H new ATOM 0 HA VAL A 24 7.530 3.939 -1.958 1.00 0.00 H new ATOM 0 HB VAL A 24 8.743 2.991 -4.596 1.00 0.00 H new ATOM 0 HG11 VAL A 24 9.657 1.108 -3.272 1.00 0.00 H new ATOM 0 HG12 VAL A 24 10.319 2.663 -2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.039 1.855 -1.781 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.329 0.987 -4.172 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.706 1.743 -2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.334 2.459 -4.272 1.00 0.00 H new ATOM 393 N ILE A 25 9.673 5.049 -1.421 1.00 0.00 N ATOM 394 CA ILE A 25 10.923 5.784 -1.067 1.00 0.00 C ATOM 395 C ILE A 25 12.017 4.768 -0.741 1.00 0.00 C ATOM 396 O ILE A 25 13.098 4.796 -1.299 1.00 0.00 O ATOM 397 CB ILE A 25 10.670 6.648 0.167 1.00 0.00 C ATOM 398 CG1 ILE A 25 9.654 7.747 -0.170 1.00 0.00 C ATOM 399 CG2 ILE A 25 11.986 7.286 0.623 1.00 0.00 C ATOM 400 CD1 ILE A 25 9.202 8.464 1.113 1.00 0.00 C ATOM 0 H ILE A 25 9.158 4.675 -0.624 1.00 0.00 H new ATOM 0 HA ILE A 25 11.229 6.414 -1.902 1.00 0.00 H new ATOM 0 HB ILE A 25 10.272 6.025 0.968 1.00 0.00 H new ATOM 0 HG12 ILE A 25 10.099 8.465 -0.859 1.00 0.00 H new ATOM 0 HG13 ILE A 25 8.792 7.312 -0.676 1.00 0.00 H new ATOM 0 HG21 ILE A 25 11.806 7.903 1.504 1.00 0.00 H new ATOM 0 HG22 ILE A 25 12.704 6.503 0.869 1.00 0.00 H new ATOM 0 HG23 ILE A 25 12.386 7.907 -0.179 1.00 0.00 H new ATOM 0 HD11 ILE A 25 8.481 9.242 0.861 1.00 0.00 H new ATOM 0 HD12 ILE A 25 8.738 7.744 1.788 1.00 0.00 H new ATOM 0 HD13 ILE A 25 10.066 8.915 1.601 1.00 0.00 H new ATOM 412 N GLN A 26 11.745 3.866 0.167 1.00 0.00 N ATOM 413 CA GLN A 26 12.768 2.847 0.535 1.00 0.00 C ATOM 414 C GLN A 26 12.076 1.532 0.904 1.00 0.00 C ATOM 415 O GLN A 26 10.971 1.509 1.426 1.00 0.00 O ATOM 416 CB GLN A 26 13.580 3.347 1.731 1.00 0.00 C ATOM 417 CG GLN A 26 14.723 2.372 2.035 1.00 0.00 C ATOM 418 CD GLN A 26 15.706 2.349 0.861 1.00 0.00 C ATOM 419 OE1 GLN A 26 15.978 3.371 0.259 1.00 0.00 O ATOM 420 NE2 GLN A 26 16.252 1.219 0.505 1.00 0.00 N ATOM 0 H GLN A 26 10.859 3.793 0.668 1.00 0.00 H new ATOM 0 HA GLN A 26 13.432 2.681 -0.313 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.983 4.337 1.519 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.934 3.446 2.603 1.00 0.00 H new ATOM 0 HG2 GLN A 26 15.238 2.673 2.947 1.00 0.00 H new ATOM 0 HG3 GLN A 26 14.325 1.372 2.209 1.00 0.00 H new ATOM 0 HE21 GLN A 26 16.025 0.362 1.009 1.00 0.00 H new ATOM 0 HE22 GLN A 26 16.906 1.193 -0.277 1.00 0.00 H new ATOM 429 N LEU A 27 12.740 0.434 0.641 1.00 0.00 N ATOM 430 CA LEU A 27 12.171 -0.907 0.966 1.00 0.00 C ATOM 431 C LEU A 27 13.285 -1.819 1.477 1.00 0.00 C ATOM 432 O LEU A 27 14.371 -1.856 0.932 1.00 0.00 O ATOM 433 CB LEU A 27 11.504 -1.518 -0.280 1.00 0.00 C ATOM 434 CG LEU A 27 12.550 -1.897 -1.342 1.00 0.00 C ATOM 435 CD1 LEU A 27 11.832 -2.456 -2.577 1.00 0.00 C ATOM 436 CD2 LEU A 27 13.371 -0.659 -1.744 1.00 0.00 C ATOM 0 H LEU A 27 13.664 0.411 0.209 1.00 0.00 H new ATOM 0 HA LEU A 27 11.413 -0.800 1.742 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.935 -2.403 0.006 1.00 0.00 H new ATOM 0 HB3 LEU A 27 10.795 -0.806 -0.702 1.00 0.00 H new ATOM 0 HG LEU A 27 13.223 -2.649 -0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.568 -2.727 -3.334 1.00 0.00 H new ATOM 0 HD12 LEU A 27 11.259 -3.339 -2.296 1.00 0.00 H new ATOM 0 HD13 LEU A 27 11.159 -1.700 -2.980 1.00 0.00 H new ATOM 0 HD21 LEU A 27 14.108 -0.940 -2.496 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.706 0.101 -2.154 1.00 0.00 H new ATOM 0 HD23 LEU A 27 13.881 -0.260 -0.867 1.00 0.00 H new ATOM 448 N TRP A 28 13.022 -2.547 2.535 1.00 0.00 N ATOM 449 CA TRP A 28 14.052 -3.464 3.116 1.00 0.00 C ATOM 450 C TRP A 28 13.518 -4.897 3.113 1.00 0.00 C ATOM 451 O TRP A 28 12.569 -5.225 3.803 1.00 0.00 O ATOM 452 CB TRP A 28 14.358 -3.031 4.551 1.00 0.00 C ATOM 453 CG TRP A 28 14.649 -1.563 4.574 1.00 0.00 C ATOM 454 CD1 TRP A 28 15.620 -0.952 3.855 1.00 0.00 C ATOM 455 CD2 TRP A 28 13.983 -0.513 5.336 1.00 0.00 C ATOM 456 NE1 TRP A 28 15.595 0.403 4.130 1.00 0.00 N ATOM 457 CE2 TRP A 28 14.604 0.723 5.037 1.00 0.00 C ATOM 458 CE3 TRP A 28 12.914 -0.513 6.249 1.00 0.00 C ATOM 459 CZ2 TRP A 28 14.178 1.916 5.622 1.00 0.00 C ATOM 460 CZ3 TRP A 28 12.482 0.686 6.840 1.00 0.00 C ATOM 461 CH2 TRP A 28 13.114 1.899 6.527 1.00 0.00 C ATOM 0 H TRP A 28 12.128 -2.545 3.026 1.00 0.00 H new ATOM 0 HA TRP A 28 14.963 -3.419 2.520 1.00 0.00 H new ATOM 0 HB2 TRP A 28 13.511 -3.256 5.199 1.00 0.00 H new ATOM 0 HB3 TRP A 28 15.211 -3.589 4.937 1.00 0.00 H new ATOM 0 HD1 TRP A 28 16.303 -1.443 3.177 1.00 0.00 H new ATOM 0 HE1 TRP A 28 16.231 1.083 3.714 1.00 0.00 H new ATOM 0 HE3 TRP A 28 12.421 -1.441 6.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 14.668 2.847 5.377 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 11.659 0.674 7.539 1.00 0.00 H new ATOM 0 HH2 TRP A 28 12.778 2.818 6.985 1.00 0.00 H new ATOM 472 N GLU A 29 14.128 -5.752 2.339 1.00 0.00 N ATOM 473 CA GLU A 29 13.678 -7.171 2.273 1.00 0.00 C ATOM 474 C GLU A 29 13.880 -7.841 3.630 1.00 0.00 C ATOM 475 O GLU A 29 14.797 -7.525 4.363 1.00 0.00 O ATOM 476 CB GLU A 29 14.491 -7.912 1.204 1.00 0.00 C ATOM 477 CG GLU A 29 15.979 -7.892 1.579 1.00 0.00 C ATOM 478 CD GLU A 29 16.801 -8.546 0.465 1.00 0.00 C ATOM 479 OE1 GLU A 29 16.296 -9.464 -0.159 1.00 0.00 O ATOM 480 OE2 GLU A 29 17.924 -8.116 0.253 1.00 0.00 O ATOM 0 H GLU A 29 14.926 -5.526 1.745 1.00 0.00 H new ATOM 0 HA GLU A 29 12.620 -7.204 2.014 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.142 -8.941 1.116 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.345 -7.442 0.232 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.311 -6.865 1.734 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.134 -8.423 2.518 1.00 0.00 H new ATOM 487 N ASN A 30 13.023 -8.769 3.967 1.00 0.00 N ATOM 488 CA ASN A 30 13.141 -9.482 5.273 1.00 0.00 C ATOM 489 C ASN A 30 12.987 -10.986 5.029 1.00 0.00 C ATOM 490 O ASN A 30 13.688 -11.793 5.611 1.00 0.00 O ATOM 491 CB ASN A 30 12.033 -8.986 6.218 1.00 0.00 C ATOM 492 CG ASN A 30 10.680 -9.591 5.818 1.00 0.00 C ATOM 493 OD1 ASN A 30 10.189 -9.345 4.635 1.00 0.00 O flip ATOM 494 ND2 ASN A 30 10.067 -10.300 6.592 1.00 0.00 N flip ATOM 0 H ASN A 30 12.238 -9.066 3.387 1.00 0.00 H new ATOM 0 HA ASN A 30 14.113 -9.286 5.726 1.00 0.00 H new ATOM 0 HB2 ASN A 30 12.272 -9.261 7.245 1.00 0.00 H new ATOM 0 HB3 ASN A 30 11.977 -7.898 6.184 1.00 0.00 H new ATOM 0 HD21 ASN A 30 10.449 -10.494 7.518 1.00 0.00 H new ATOM 0 HD22 ASN A 30 9.171 -10.701 6.316 1.00 0.00 H new ATOM 501 N THR A 31 12.064 -11.358 4.173 1.00 0.00 N ATOM 502 CA THR A 31 11.828 -12.807 3.881 1.00 0.00 C ATOM 503 C THR A 31 11.941 -13.615 5.179 1.00 0.00 C ATOM 504 O THR A 31 12.620 -14.622 5.255 1.00 0.00 O ATOM 505 CB THR A 31 12.850 -13.307 2.849 1.00 0.00 C ATOM 506 OG1 THR A 31 14.022 -13.753 3.515 1.00 0.00 O ATOM 507 CG2 THR A 31 13.205 -12.170 1.889 1.00 0.00 C ATOM 0 H THR A 31 11.460 -10.715 3.661 1.00 0.00 H new ATOM 0 HA THR A 31 10.827 -12.936 3.468 1.00 0.00 H new ATOM 0 HB THR A 31 12.420 -14.135 2.286 1.00 0.00 H new ATOM 0 HG1 THR A 31 13.816 -14.556 4.038 1.00 0.00 H new ATOM 0 HG21 THR A 31 13.930 -12.525 1.157 1.00 0.00 H new ATOM 0 HG22 THR A 31 12.305 -11.834 1.375 1.00 0.00 H new ATOM 0 HG23 THR A 31 13.633 -11.340 2.451 1.00 0.00 H new ATOM 515 N HIS A 32 11.273 -13.163 6.206 1.00 0.00 N ATOM 516 CA HIS A 32 11.323 -13.880 7.510 1.00 0.00 C ATOM 517 C HIS A 32 10.731 -15.278 7.334 1.00 0.00 C ATOM 518 O HIS A 32 11.314 -16.265 7.735 1.00 0.00 O ATOM 519 CB HIS A 32 10.498 -13.104 8.543 1.00 0.00 C ATOM 520 CG HIS A 32 10.556 -13.808 9.873 1.00 0.00 C ATOM 521 ND1 HIS A 32 11.750 -14.027 10.542 1.00 0.00 N ATOM 522 CD2 HIS A 32 9.576 -14.345 10.672 1.00 0.00 C ATOM 523 CE1 HIS A 32 11.461 -14.673 11.687 1.00 0.00 C ATOM 524 NE2 HIS A 32 10.151 -14.892 11.816 1.00 0.00 N ATOM 0 H HIS A 32 10.693 -12.324 6.196 1.00 0.00 H new ATOM 0 HA HIS A 32 12.355 -13.959 7.851 1.00 0.00 H new ATOM 0 HB2 HIS A 32 10.883 -12.089 8.641 1.00 0.00 H new ATOM 0 HB3 HIS A 32 9.464 -13.022 8.209 1.00 0.00 H new ATOM 0 HD2 HIS A 32 8.520 -14.343 10.447 1.00 0.00 H new ATOM 0 HE1 HIS A 32 12.200 -14.977 12.413 1.00 0.00 H new ATOM 0 HE2 HIS A 32 9.674 -15.359 12.587 1.00 0.00 H new ATOM 532 N GLU A 33 9.579 -15.360 6.725 1.00 0.00 N ATOM 533 CA GLU A 33 8.926 -16.686 6.507 1.00 0.00 C ATOM 534 C GLU A 33 7.638 -16.492 5.703 1.00 0.00 C ATOM 535 O GLU A 33 7.376 -17.201 4.751 1.00 0.00 O ATOM 536 CB GLU A 33 8.583 -17.331 7.858 1.00 0.00 C ATOM 537 CG GLU A 33 7.535 -16.482 8.585 1.00 0.00 C ATOM 538 CD GLU A 33 7.478 -16.900 10.054 1.00 0.00 C ATOM 539 OE1 GLU A 33 8.113 -17.883 10.393 1.00 0.00 O ATOM 540 OE2 GLU A 33 6.802 -16.226 10.816 1.00 0.00 O ATOM 0 H GLU A 33 9.057 -14.560 6.366 1.00 0.00 H new ATOM 0 HA GLU A 33 9.611 -17.335 5.961 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.203 -18.341 7.704 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.482 -17.418 8.469 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.788 -15.425 8.505 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.558 -16.612 8.120 1.00 0.00 H new ATOM 547 N SER A 34 6.828 -15.537 6.090 1.00 0.00 N ATOM 548 CA SER A 34 5.542 -15.275 5.368 1.00 0.00 C ATOM 549 C SER A 34 5.531 -13.831 4.868 1.00 0.00 C ATOM 550 O SER A 34 4.644 -13.423 4.141 1.00 0.00 O ATOM 551 CB SER A 34 4.370 -15.490 6.331 1.00 0.00 C ATOM 552 OG SER A 34 4.355 -14.438 7.287 1.00 0.00 O ATOM 0 H SER A 34 7.004 -14.921 6.884 1.00 0.00 H new ATOM 0 HA SER A 34 5.449 -15.955 4.522 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.430 -15.511 5.780 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.467 -16.453 6.833 1.00 0.00 H new ATOM 0 HG SER A 34 3.606 -14.569 7.905 1.00 0.00 H new ATOM 558 N ILE A 35 6.512 -13.049 5.251 1.00 0.00 N ATOM 559 CA ILE A 35 6.562 -11.621 4.802 1.00 0.00 C ATOM 560 C ILE A 35 7.656 -11.440 3.749 1.00 0.00 C ATOM 561 O ILE A 35 8.802 -11.800 3.947 1.00 0.00 O ATOM 562 CB ILE A 35 6.853 -10.715 6.000 1.00 0.00 C ATOM 563 CG1 ILE A 35 5.749 -10.896 7.046 1.00 0.00 C ATOM 564 CG2 ILE A 35 6.875 -9.257 5.535 1.00 0.00 C ATOM 565 CD1 ILE A 35 6.144 -10.186 8.342 1.00 0.00 C ATOM 0 H ILE A 35 7.281 -13.338 5.856 1.00 0.00 H new ATOM 0 HA ILE A 35 5.599 -11.353 4.367 1.00 0.00 H new ATOM 0 HB ILE A 35 7.818 -10.976 6.435 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.809 -10.491 6.670 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.586 -11.957 7.236 1.00 0.00 H new ATOM 0 HG21 ILE A 35 7.082 -8.607 6.385 1.00 0.00 H new ATOM 0 HG22 ILE A 35 7.652 -9.127 4.781 1.00 0.00 H new ATOM 0 HG23 ILE A 35 5.907 -8.997 5.107 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.356 -10.317 9.083 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.073 -10.611 8.721 1.00 0.00 H new ATOM 0 HD13 ILE A 35 6.285 -9.123 8.146 1.00 0.00 H new ATOM 577 N SER A 36 7.299 -10.878 2.628 1.00 0.00 N ATOM 578 CA SER A 36 8.286 -10.651 1.535 1.00 0.00 C ATOM 579 C SER A 36 9.225 -9.507 1.915 1.00 0.00 C ATOM 580 O SER A 36 10.376 -9.710 2.257 1.00 0.00 O ATOM 581 CB SER A 36 7.536 -10.260 0.264 1.00 0.00 C ATOM 582 OG SER A 36 6.607 -11.276 -0.072 1.00 0.00 O ATOM 0 H SER A 36 6.352 -10.562 2.420 1.00 0.00 H new ATOM 0 HA SER A 36 8.862 -11.562 1.375 1.00 0.00 H new ATOM 0 HB2 SER A 36 7.017 -9.313 0.413 1.00 0.00 H new ATOM 0 HB3 SER A 36 8.240 -10.112 -0.555 1.00 0.00 H new ATOM 0 HG SER A 36 6.125 -11.022 -0.887 1.00 0.00 H new ATOM 588 N GLN A 37 8.741 -8.297 1.845 1.00 0.00 N ATOM 589 CA GLN A 37 9.596 -7.124 2.185 1.00 0.00 C ATOM 590 C GLN A 37 8.740 -6.032 2.822 1.00 0.00 C ATOM 591 O GLN A 37 7.524 -6.027 2.709 1.00 0.00 O ATOM 592 CB GLN A 37 10.253 -6.576 0.913 1.00 0.00 C ATOM 593 CG GLN A 37 9.176 -6.184 -0.101 1.00 0.00 C ATOM 594 CD GLN A 37 9.847 -5.700 -1.389 1.00 0.00 C ATOM 595 OE1 GLN A 37 11.023 -5.927 -1.600 1.00 0.00 O ATOM 596 NE2 GLN A 37 9.145 -5.040 -2.269 1.00 0.00 N ATOM 0 H GLN A 37 7.787 -8.069 1.566 1.00 0.00 H new ATOM 0 HA GLN A 37 10.369 -7.437 2.887 1.00 0.00 H new ATOM 0 HB2 GLN A 37 10.869 -5.710 1.155 1.00 0.00 H new ATOM 0 HB3 GLN A 37 10.915 -7.327 0.482 1.00 0.00 H new ATOM 0 HG2 GLN A 37 8.531 -7.037 -0.312 1.00 0.00 H new ATOM 0 HG3 GLN A 37 8.542 -5.398 0.310 1.00 0.00 H new ATOM 0 HE21 GLN A 37 8.158 -4.848 -2.095 1.00 0.00 H new ATOM 0 HE22 GLN A 37 9.583 -4.716 -3.131 1.00 0.00 H new ATOM 605 N VAL A 38 9.373 -5.105 3.496 1.00 0.00 N ATOM 606 CA VAL A 38 8.623 -3.995 4.155 1.00 0.00 C ATOM 607 C VAL A 38 9.279 -2.661 3.819 1.00 0.00 C ATOM 608 O VAL A 38 10.435 -2.594 3.445 1.00 0.00 O ATOM 609 CB VAL A 38 8.631 -4.204 5.672 1.00 0.00 C ATOM 610 CG1 VAL A 38 7.945 -5.532 5.998 1.00 0.00 C ATOM 611 CG2 VAL A 38 10.073 -4.232 6.194 1.00 0.00 C ATOM 0 H VAL A 38 10.385 -5.070 3.618 1.00 0.00 H new ATOM 0 HA VAL A 38 7.594 -3.990 3.794 1.00 0.00 H new ATOM 0 HB VAL A 38 8.098 -3.383 6.151 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.947 -5.687 7.077 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.917 -5.509 5.637 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.482 -6.347 5.513 1.00 0.00 H new ATOM 0 HG21 VAL A 38 10.066 -4.381 7.274 1.00 0.00 H new ATOM 0 HG22 VAL A 38 10.616 -5.048 5.718 1.00 0.00 H new ATOM 0 HG23 VAL A 38 10.563 -3.286 5.961 1.00 0.00 H new ATOM 621 N GLY A 39 8.539 -1.593 3.941 1.00 0.00 N ATOM 622 CA GLY A 39 9.109 -0.258 3.621 1.00 0.00 C ATOM 623 C GLY A 39 8.064 0.822 3.872 1.00 0.00 C ATOM 624 O GLY A 39 7.100 0.619 4.583 1.00 0.00 O ATOM 0 H GLY A 39 7.566 -1.589 4.248 1.00 0.00 H new ATOM 0 HA2 GLY A 39 9.991 -0.073 4.233 1.00 0.00 H new ATOM 0 HA3 GLY A 39 9.432 -0.230 2.580 1.00 0.00 H new ATOM 628 N LEU A 40 8.255 1.978 3.291 1.00 0.00 N ATOM 629 CA LEU A 40 7.277 3.094 3.492 1.00 0.00 C ATOM 630 C LEU A 40 7.054 3.845 2.185 1.00 0.00 C ATOM 631 O LEU A 40 7.936 3.949 1.354 1.00 0.00 O ATOM 632 CB LEU A 40 7.802 4.047 4.578 1.00 0.00 C ATOM 633 CG LEU A 40 9.004 4.856 4.057 1.00 0.00 C ATOM 634 CD1 LEU A 40 9.528 5.757 5.177 1.00 0.00 C ATOM 635 CD2 LEU A 40 10.121 3.902 3.601 1.00 0.00 C ATOM 0 H LEU A 40 9.045 2.200 2.686 1.00 0.00 H new ATOM 0 HA LEU A 40 6.321 2.680 3.814 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.008 4.726 4.888 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.096 3.476 5.459 1.00 0.00 H new ATOM 0 HG LEU A 40 8.689 5.465 3.210 1.00 0.00 H new ATOM 0 HD11 LEU A 40 10.379 6.332 4.813 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.739 6.439 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 40 9.839 5.143 6.022 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.968 4.482 3.234 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.440 3.287 4.442 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.748 3.260 2.803 1.00 0.00 H new ATOM 647 N LEU A 41 5.865 4.364 1.998 1.00 0.00 N ATOM 648 CA LEU A 41 5.545 5.107 0.746 1.00 0.00 C ATOM 649 C LEU A 41 5.401 6.594 1.062 1.00 0.00 C ATOM 650 O LEU A 41 4.755 6.983 2.021 1.00 0.00 O ATOM 651 CB LEU A 41 4.225 4.592 0.177 1.00 0.00 C ATOM 652 CG LEU A 41 4.247 3.063 0.105 1.00 0.00 C ATOM 653 CD1 LEU A 41 2.892 2.561 -0.398 1.00 0.00 C ATOM 654 CD2 LEU A 41 5.349 2.604 -0.855 1.00 0.00 C ATOM 0 H LEU A 41 5.098 4.302 2.667 1.00 0.00 H new ATOM 0 HA LEU A 41 6.345 4.959 0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.396 4.923 0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 41 4.061 5.009 -0.817 1.00 0.00 H new ATOM 0 HG LEU A 41 4.444 2.658 1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.904 1.472 -0.451 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.108 2.883 0.287 1.00 0.00 H new ATOM 0 HD13 LEU A 41 2.698 2.970 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU A 41 5.360 1.515 -0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 41 5.157 3.008 -1.849 1.00 0.00 H new ATOM 0 HD23 LEU A 41 6.315 2.961 -0.498 1.00 0.00 H new ATOM 666 N GLY A 42 6.006 7.423 0.258 1.00 0.00 N ATOM 667 CA GLY A 42 5.929 8.892 0.482 1.00 0.00 C ATOM 668 C GLY A 42 4.634 9.449 -0.107 1.00 0.00 C ATOM 669 O GLY A 42 3.988 8.825 -0.929 1.00 0.00 O ATOM 0 H GLY A 42 6.556 7.141 -0.553 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.973 9.107 1.550 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.787 9.383 0.022 1.00 0.00 H new ATOM 673 N ASP A 43 4.261 10.630 0.308 1.00 0.00 N ATOM 674 CA ASP A 43 3.018 11.255 -0.215 1.00 0.00 C ATOM 675 C ASP A 43 2.917 12.693 0.302 1.00 0.00 C ATOM 676 O ASP A 43 3.286 12.996 1.421 1.00 0.00 O ATOM 677 CB ASP A 43 1.797 10.452 0.251 1.00 0.00 C ATOM 678 CG ASP A 43 0.526 11.035 -0.372 1.00 0.00 C ATOM 679 OD1 ASP A 43 0.620 12.074 -1.004 1.00 0.00 O ATOM 680 OD2 ASP A 43 -0.520 10.430 -0.209 1.00 0.00 O ATOM 0 H ASP A 43 4.770 11.190 0.992 1.00 0.00 H new ATOM 0 HA ASP A 43 3.046 11.261 -1.305 1.00 0.00 H new ATOM 0 HB2 ASP A 43 1.907 9.406 -0.035 1.00 0.00 H new ATOM 0 HB3 ASP A 43 1.726 10.479 1.338 1.00 0.00 H new ATOM 685 N GLU A 44 2.416 13.577 -0.515 1.00 0.00 N ATOM 686 CA GLU A 44 2.273 15.004 -0.104 1.00 0.00 C ATOM 687 C GLU A 44 1.468 15.087 1.200 1.00 0.00 C ATOM 688 O GLU A 44 1.446 16.104 1.868 1.00 0.00 O ATOM 689 CB GLU A 44 1.540 15.766 -1.214 1.00 0.00 C ATOM 690 CG GLU A 44 2.425 15.833 -2.463 1.00 0.00 C ATOM 691 CD GLU A 44 1.673 16.534 -3.598 1.00 0.00 C ATOM 692 OE1 GLU A 44 0.553 16.960 -3.368 1.00 0.00 O ATOM 693 OE2 GLU A 44 2.231 16.635 -4.679 1.00 0.00 O ATOM 0 H GLU A 44 2.096 13.370 -1.461 1.00 0.00 H new ATOM 0 HA GLU A 44 3.257 15.444 0.059 1.00 0.00 H new ATOM 0 HB2 GLU A 44 0.599 15.269 -1.449 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.294 16.773 -0.876 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.346 16.371 -2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 44 2.711 14.827 -2.771 1.00 0.00 H new ATOM 700 N THR A 45 0.802 14.022 1.567 1.00 0.00 N ATOM 701 CA THR A 45 -0.006 14.029 2.823 1.00 0.00 C ATOM 702 C THR A 45 0.832 13.472 3.974 1.00 0.00 C ATOM 703 O THR A 45 0.464 13.570 5.130 1.00 0.00 O ATOM 704 CB THR A 45 -1.247 13.155 2.624 1.00 0.00 C ATOM 705 OG1 THR A 45 -0.849 11.797 2.477 1.00 0.00 O ATOM 706 CG2 THR A 45 -1.991 13.614 1.370 1.00 0.00 C ATOM 0 H THR A 45 0.783 13.144 1.048 1.00 0.00 H new ATOM 0 HA THR A 45 -0.308 15.049 3.060 1.00 0.00 H new ATOM 0 HB THR A 45 -1.905 13.246 3.489 1.00 0.00 H new ATOM 0 HG1 THR A 45 -1.395 11.369 1.785 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.876 12.994 1.224 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.292 14.655 1.486 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.336 13.521 0.504 1.00 0.00 H new ATOM 714 N GLY A 46 1.967 12.894 3.674 1.00 0.00 N ATOM 715 CA GLY A 46 2.837 12.341 4.759 1.00 0.00 C ATOM 716 C GLY A 46 3.451 11.013 4.321 1.00 0.00 C ATOM 717 O GLY A 46 3.605 10.738 3.146 1.00 0.00 O ATOM 0 H GLY A 46 2.329 12.781 2.727 1.00 0.00 H new ATOM 0 HA2 GLY A 46 3.627 13.053 5.000 1.00 0.00 H new ATOM 0 HA3 GLY A 46 2.251 12.197 5.667 1.00 0.00 H new ATOM 721 N ILE A 47 3.813 10.190 5.274 1.00 0.00 N ATOM 722 CA ILE A 47 4.438 8.868 4.960 1.00 0.00 C ATOM 723 C ILE A 47 3.673 7.752 5.664 1.00 0.00 C ATOM 724 O ILE A 47 3.101 7.942 6.719 1.00 0.00 O ATOM 725 CB ILE A 47 5.894 8.869 5.446 1.00 0.00 C ATOM 726 CG1 ILE A 47 5.950 9.144 6.958 1.00 0.00 C ATOM 727 CG2 ILE A 47 6.672 9.953 4.705 1.00 0.00 C ATOM 728 CD1 ILE A 47 7.393 9.007 7.450 1.00 0.00 C ATOM 0 H ILE A 47 3.700 10.381 6.270 1.00 0.00 H new ATOM 0 HA ILE A 47 4.406 8.701 3.883 1.00 0.00 H new ATOM 0 HB ILE A 47 6.336 7.893 5.247 1.00 0.00 H new ATOM 0 HG12 ILE A 47 5.576 10.146 7.170 1.00 0.00 H new ATOM 0 HG13 ILE A 47 5.305 8.444 7.490 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.707 9.957 5.048 1.00 0.00 H new ATOM 0 HG22 ILE A 47 6.645 9.752 3.634 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.221 10.925 4.904 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.432 9.202 8.522 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.751 7.997 7.252 1.00 0.00 H new ATOM 0 HD13 ILE A 47 8.025 9.725 6.927 1.00 0.00 H new ATOM 740 N ILE A 48 3.673 6.580 5.088 1.00 0.00 N ATOM 741 CA ILE A 48 2.960 5.431 5.721 1.00 0.00 C ATOM 742 C ILE A 48 3.746 4.141 5.477 1.00 0.00 C ATOM 743 O ILE A 48 4.315 3.931 4.422 1.00 0.00 O ATOM 744 CB ILE A 48 1.546 5.304 5.144 1.00 0.00 C ATOM 745 CG1 ILE A 48 0.736 4.335 6.010 1.00 0.00 C ATOM 746 CG2 ILE A 48 1.610 4.779 3.707 1.00 0.00 C ATOM 747 CD1 ILE A 48 -0.731 4.371 5.586 1.00 0.00 C ATOM 0 H ILE A 48 4.137 6.368 4.205 1.00 0.00 H new ATOM 0 HA ILE A 48 2.883 5.606 6.794 1.00 0.00 H new ATOM 0 HB ILE A 48 1.068 6.284 5.140 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.130 3.324 5.907 1.00 0.00 H new ATOM 0 HG13 ILE A 48 0.828 4.608 7.061 1.00 0.00 H new ATOM 0 HG21 ILE A 48 0.600 4.692 3.306 1.00 0.00 H new ATOM 0 HG22 ILE A 48 2.186 5.470 3.092 1.00 0.00 H new ATOM 0 HG23 ILE A 48 2.089 3.800 3.698 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -1.305 3.681 6.204 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.121 5.381 5.712 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -0.815 4.077 4.540 1.00 0.00 H new ATOM 759 N LYS A 49 3.782 3.282 6.458 1.00 0.00 N ATOM 760 CA LYS A 49 4.529 1.999 6.322 1.00 0.00 C ATOM 761 C LYS A 49 3.653 0.943 5.657 1.00 0.00 C ATOM 762 O LYS A 49 2.439 1.007 5.700 1.00 0.00 O ATOM 763 CB LYS A 49 4.952 1.518 7.703 1.00 0.00 C ATOM 764 CG LYS A 49 5.978 2.496 8.275 1.00 0.00 C ATOM 765 CD LYS A 49 6.427 2.012 9.650 1.00 0.00 C ATOM 766 CE LYS A 49 7.445 2.994 10.235 1.00 0.00 C ATOM 767 NZ LYS A 49 7.852 2.540 11.595 1.00 0.00 N ATOM 0 H LYS A 49 3.321 3.416 7.358 1.00 0.00 H new ATOM 0 HA LYS A 49 5.410 2.162 5.701 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.086 1.453 8.361 1.00 0.00 H new ATOM 0 HB3 LYS A 49 5.380 0.517 7.639 1.00 0.00 H new ATOM 0 HG2 LYS A 49 6.835 2.573 7.606 1.00 0.00 H new ATOM 0 HG3 LYS A 49 5.543 3.493 8.352 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.567 1.926 10.314 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.869 1.019 9.570 1.00 0.00 H new ATOM 0 HE2 LYS A 49 8.318 3.059 9.586 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.013 3.993 10.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.650 3.117 11.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.051 2.645 12.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 8.139 1.541 11.556 1.00 0.00 H new ATOM 781 N PHE A 50 4.260 -0.037 5.036 1.00 0.00 N ATOM 782 CA PHE A 50 3.464 -1.105 4.366 1.00 0.00 C ATOM 783 C PHE A 50 4.181 -2.448 4.504 1.00 0.00 C ATOM 784 O PHE A 50 5.399 -2.515 4.595 1.00 0.00 O ATOM 785 CB PHE A 50 3.297 -0.772 2.878 1.00 0.00 C ATOM 786 CG PHE A 50 4.610 -0.958 2.142 1.00 0.00 C ATOM 787 CD1 PHE A 50 5.528 0.094 2.055 1.00 0.00 C ATOM 788 CD2 PHE A 50 4.899 -2.189 1.539 1.00 0.00 C ATOM 789 CE1 PHE A 50 6.736 -0.084 1.365 1.00 0.00 C ATOM 790 CE2 PHE A 50 6.105 -2.367 0.849 1.00 0.00 C ATOM 791 CZ PHE A 50 7.023 -1.315 0.761 1.00 0.00 C ATOM 0 H PHE A 50 5.272 -0.142 4.965 1.00 0.00 H new ATOM 0 HA PHE A 50 2.483 -1.165 4.838 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.533 -1.414 2.439 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.953 0.256 2.766 1.00 0.00 H new ATOM 0 HD1 PHE A 50 5.306 1.044 2.519 1.00 0.00 H new ATOM 0 HD2 PHE A 50 4.191 -3.002 1.606 1.00 0.00 H new ATOM 0 HE1 PHE A 50 7.445 0.728 1.299 1.00 0.00 H new ATOM 0 HE2 PHE A 50 6.326 -3.317 0.385 1.00 0.00 H new ATOM 0 HZ PHE A 50 7.952 -1.452 0.228 1.00 0.00 H new ATOM 801 N THR A 51 3.427 -3.517 4.507 1.00 0.00 N ATOM 802 CA THR A 51 4.025 -4.879 4.620 1.00 0.00 C ATOM 803 C THR A 51 3.399 -5.798 3.573 1.00 0.00 C ATOM 804 O THR A 51 2.192 -5.925 3.477 1.00 0.00 O ATOM 805 CB THR A 51 3.763 -5.438 6.021 1.00 0.00 C ATOM 806 OG1 THR A 51 4.462 -4.651 6.976 1.00 0.00 O ATOM 807 CG2 THR A 51 4.241 -6.891 6.098 1.00 0.00 C ATOM 0 H THR A 51 2.410 -3.503 4.435 1.00 0.00 H new ATOM 0 HA THR A 51 5.100 -4.820 4.452 1.00 0.00 H new ATOM 0 HB THR A 51 2.694 -5.405 6.232 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.296 -5.004 7.875 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.052 -7.284 7.097 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.702 -7.491 5.365 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.310 -6.934 5.887 1.00 0.00 H new ATOM 815 N ILE A 52 4.220 -6.446 2.787 1.00 0.00 N ATOM 816 CA ILE A 52 3.693 -7.368 1.736 1.00 0.00 C ATOM 817 C ILE A 52 3.667 -8.800 2.269 1.00 0.00 C ATOM 818 O ILE A 52 4.672 -9.335 2.699 1.00 0.00 O ATOM 819 CB ILE A 52 4.599 -7.297 0.504 1.00 0.00 C ATOM 820 CG1 ILE A 52 4.477 -5.911 -0.137 1.00 0.00 C ATOM 821 CG2 ILE A 52 4.187 -8.370 -0.508 1.00 0.00 C ATOM 822 CD1 ILE A 52 5.567 -5.737 -1.196 1.00 0.00 C ATOM 0 H ILE A 52 5.237 -6.376 2.828 1.00 0.00 H new ATOM 0 HA ILE A 52 2.680 -7.069 1.466 1.00 0.00 H new ATOM 0 HB ILE A 52 5.632 -7.470 0.806 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.493 -5.795 -0.591 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.570 -5.137 0.625 1.00 0.00 H new ATOM 0 HG21 ILE A 52 4.836 -8.314 -1.382 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.278 -9.355 -0.051 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.153 -8.206 -0.812 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.478 -4.750 -1.651 1.00 0.00 H new ATOM 0 HD12 ILE A 52 6.547 -5.835 -0.729 1.00 0.00 H new ATOM 0 HD13 ILE A 52 5.453 -6.502 -1.964 1.00 0.00 H new ATOM 834 N TRP A 53 2.524 -9.430 2.230 1.00 0.00 N ATOM 835 CA TRP A 53 2.429 -10.833 2.719 1.00 0.00 C ATOM 836 C TRP A 53 2.886 -11.781 1.609 1.00 0.00 C ATOM 837 O TRP A 53 2.194 -12.002 0.633 1.00 0.00 O ATOM 838 CB TRP A 53 0.981 -11.137 3.112 1.00 0.00 C ATOM 839 CG TRP A 53 0.658 -10.428 4.390 1.00 0.00 C ATOM 840 CD1 TRP A 53 -0.172 -9.365 4.504 1.00 0.00 C ATOM 841 CD2 TRP A 53 1.153 -10.706 5.733 1.00 0.00 C ATOM 842 NE1 TRP A 53 -0.224 -8.979 5.831 1.00 0.00 N ATOM 843 CE2 TRP A 53 0.576 -9.775 6.628 1.00 0.00 C ATOM 844 CE3 TRP A 53 2.035 -11.670 6.255 1.00 0.00 C ATOM 845 CZ2 TRP A 53 0.865 -9.796 7.993 1.00 0.00 C ATOM 846 CZ3 TRP A 53 2.328 -11.695 7.629 1.00 0.00 C ATOM 847 CH2 TRP A 53 1.743 -10.760 8.495 1.00 0.00 C ATOM 0 H TRP A 53 1.652 -9.032 1.880 1.00 0.00 H new ATOM 0 HA TRP A 53 3.068 -10.969 3.592 1.00 0.00 H new ATOM 0 HB2 TRP A 53 0.302 -10.815 2.322 1.00 0.00 H new ATOM 0 HB3 TRP A 53 0.843 -12.211 3.233 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -0.706 -8.895 3.692 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -0.785 -8.201 6.179 1.00 0.00 H new ATOM 0 HE3 TRP A 53 2.489 -12.395 5.596 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 0.414 -9.073 8.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 3.007 -12.438 8.020 1.00 0.00 H new ATOM 0 HH2 TRP A 53 1.971 -10.785 9.550 1.00 0.00 H new ATOM 858 N LYS A 54 4.058 -12.335 1.755 1.00 0.00 N ATOM 859 CA LYS A 54 4.592 -13.265 0.719 1.00 0.00 C ATOM 860 C LYS A 54 3.566 -14.365 0.434 1.00 0.00 C ATOM 861 O LYS A 54 3.704 -15.140 -0.492 1.00 0.00 O ATOM 862 CB LYS A 54 5.893 -13.893 1.239 1.00 0.00 C ATOM 863 CG LYS A 54 6.745 -14.374 0.062 1.00 0.00 C ATOM 864 CD LYS A 54 8.084 -14.913 0.577 1.00 0.00 C ATOM 865 CE LYS A 54 8.926 -15.393 -0.608 1.00 0.00 C ATOM 866 NZ LYS A 54 10.241 -15.892 -0.115 1.00 0.00 N ATOM 0 H LYS A 54 4.674 -12.182 2.554 1.00 0.00 H new ATOM 0 HA LYS A 54 4.789 -12.717 -0.203 1.00 0.00 H new ATOM 0 HB2 LYS A 54 6.449 -13.164 1.828 1.00 0.00 H new ATOM 0 HB3 LYS A 54 5.665 -14.729 1.900 1.00 0.00 H new ATOM 0 HG2 LYS A 54 6.216 -15.153 -0.487 1.00 0.00 H new ATOM 0 HG3 LYS A 54 6.916 -13.553 -0.634 1.00 0.00 H new ATOM 0 HD2 LYS A 54 8.616 -14.135 1.124 1.00 0.00 H new ATOM 0 HD3 LYS A 54 7.915 -15.734 1.274 1.00 0.00 H new ATOM 0 HE2 LYS A 54 8.402 -16.185 -1.143 1.00 0.00 H new ATOM 0 HE3 LYS A 54 9.077 -14.577 -1.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 10.813 -16.218 -0.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 10.741 -15.124 0.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 10.088 -16.682 0.543 1.00 0.00 H new ATOM 880 N ASN A 55 2.537 -14.432 1.222 1.00 0.00 N ATOM 881 CA ASN A 55 1.493 -15.470 1.005 1.00 0.00 C ATOM 882 C ASN A 55 0.829 -15.239 -0.356 1.00 0.00 C ATOM 883 O ASN A 55 0.528 -16.165 -1.084 1.00 0.00 O ATOM 884 CB ASN A 55 0.448 -15.359 2.116 1.00 0.00 C ATOM 885 CG ASN A 55 -0.699 -16.334 1.851 1.00 0.00 C ATOM 886 OD1 ASN A 55 -1.774 -15.930 1.456 1.00 0.00 O ATOM 887 ND2 ASN A 55 -0.515 -17.607 2.057 1.00 0.00 N ATOM 0 H ASN A 55 2.370 -13.810 2.013 1.00 0.00 H new ATOM 0 HA ASN A 55 1.941 -16.464 1.022 1.00 0.00 H new ATOM 0 HB2 ASN A 55 0.906 -15.576 3.081 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.066 -14.340 2.167 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -1.274 -18.266 1.887 1.00 0.00 H new ATOM 0 HD22 ASN A 55 0.389 -17.945 2.389 1.00 0.00 H new ATOM 894 N ALA A 56 0.605 -14.003 -0.705 1.00 0.00 N ATOM 895 CA ALA A 56 -0.031 -13.691 -2.019 1.00 0.00 C ATOM 896 C ALA A 56 1.007 -13.866 -3.138 1.00 0.00 C ATOM 897 O ALA A 56 0.683 -13.877 -4.313 1.00 0.00 O ATOM 898 CB ALA A 56 -0.525 -12.243 -1.994 1.00 0.00 C ATOM 0 H ALA A 56 0.836 -13.190 -0.134 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.870 -14.363 -2.200 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.992 -12.001 -2.949 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.253 -12.121 -1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.318 -11.574 -1.823 1.00 0.00 H new ATOM 904 N GLU A 57 2.253 -14.001 -2.770 1.00 0.00 N ATOM 905 CA GLU A 57 3.339 -14.173 -3.782 1.00 0.00 C ATOM 906 C GLU A 57 3.268 -13.040 -4.809 1.00 0.00 C ATOM 907 O GLU A 57 3.170 -13.258 -6.002 1.00 0.00 O ATOM 908 CB GLU A 57 3.200 -15.533 -4.473 1.00 0.00 C ATOM 909 CG GLU A 57 3.414 -16.649 -3.443 1.00 0.00 C ATOM 910 CD GLU A 57 4.872 -16.650 -2.962 1.00 0.00 C ATOM 911 OE1 GLU A 57 5.679 -15.958 -3.561 1.00 0.00 O ATOM 912 OE2 GLU A 57 5.160 -17.366 -2.017 1.00 0.00 O ATOM 0 H GLU A 57 2.569 -14.000 -1.800 1.00 0.00 H new ATOM 0 HA GLU A 57 4.308 -14.136 -3.283 1.00 0.00 H new ATOM 0 HB2 GLU A 57 2.213 -15.625 -4.926 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.929 -15.621 -5.278 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.743 -16.506 -2.596 1.00 0.00 H new ATOM 0 HG3 GLU A 57 3.168 -17.615 -3.885 1.00 0.00 H new ATOM 919 N LEU A 58 3.321 -11.821 -4.339 1.00 0.00 N ATOM 920 CA LEU A 58 3.258 -10.651 -5.261 1.00 0.00 C ATOM 921 C LEU A 58 4.680 -10.238 -5.666 1.00 0.00 C ATOM 922 O LEU A 58 5.621 -10.436 -4.923 1.00 0.00 O ATOM 923 CB LEU A 58 2.583 -9.482 -4.533 1.00 0.00 C ATOM 924 CG LEU A 58 1.054 -9.680 -4.523 1.00 0.00 C ATOM 925 CD1 LEU A 58 0.444 -8.912 -3.346 1.00 0.00 C ATOM 926 CD2 LEU A 58 0.443 -9.161 -5.834 1.00 0.00 C ATOM 0 H LEU A 58 3.406 -11.586 -3.350 1.00 0.00 H new ATOM 0 HA LEU A 58 2.690 -10.916 -6.153 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.956 -9.415 -3.511 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.833 -8.543 -5.026 1.00 0.00 H new ATOM 0 HG LEU A 58 0.839 -10.744 -4.423 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.637 -9.053 -3.341 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.863 -9.285 -2.412 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.671 -7.851 -3.447 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.637 -9.306 -5.815 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.664 -8.099 -5.943 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.868 -9.709 -6.675 1.00 0.00 H new ATOM 938 N PRO A 59 4.833 -9.660 -6.832 1.00 0.00 N ATOM 939 CA PRO A 59 6.163 -9.205 -7.333 1.00 0.00 C ATOM 940 C PRO A 59 6.741 -8.055 -6.498 1.00 0.00 C ATOM 941 O PRO A 59 6.025 -7.276 -5.896 1.00 0.00 O ATOM 942 CB PRO A 59 5.884 -8.769 -8.782 1.00 0.00 C ATOM 943 CG PRO A 59 4.423 -8.451 -8.821 1.00 0.00 C ATOM 944 CD PRO A 59 3.761 -9.377 -7.802 1.00 0.00 C ATOM 0 HA PRO A 59 6.915 -9.991 -7.266 1.00 0.00 H new ATOM 0 HB2 PRO A 59 6.484 -7.900 -9.054 1.00 0.00 H new ATOM 0 HB3 PRO A 59 6.133 -9.562 -9.487 1.00 0.00 H new ATOM 0 HG2 PRO A 59 4.245 -7.405 -8.571 1.00 0.00 H new ATOM 0 HG3 PRO A 59 4.015 -8.614 -9.819 1.00 0.00 H new ATOM 0 HD2 PRO A 59 2.906 -8.899 -7.324 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.395 -10.290 -8.271 1.00 0.00 H new ATOM 952 N LEU A 60 8.040 -7.960 -6.454 1.00 0.00 N ATOM 953 CA LEU A 60 8.692 -6.886 -5.657 1.00 0.00 C ATOM 954 C LEU A 60 8.439 -5.516 -6.294 1.00 0.00 C ATOM 955 O LEU A 60 8.514 -5.343 -7.495 1.00 0.00 O ATOM 956 CB LEU A 60 10.197 -7.151 -5.599 1.00 0.00 C ATOM 957 CG LEU A 60 10.456 -8.545 -5.012 1.00 0.00 C ATOM 958 CD1 LEU A 60 11.963 -8.821 -5.015 1.00 0.00 C ATOM 959 CD2 LEU A 60 9.920 -8.618 -3.571 1.00 0.00 C ATOM 0 H LEU A 60 8.682 -8.586 -6.940 1.00 0.00 H new ATOM 0 HA LEU A 60 8.273 -6.885 -4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.627 -7.081 -6.598 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.686 -6.392 -4.988 1.00 0.00 H new ATOM 0 HG LEU A 60 9.944 -9.292 -5.618 1.00 0.00 H new ATOM 0 HD11 LEU A 60 12.153 -9.810 -4.599 1.00 0.00 H new ATOM 0 HD12 LEU A 60 12.338 -8.779 -6.037 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.472 -8.070 -4.411 1.00 0.00 H new ATOM 0 HD21 LEU A 60 10.108 -9.611 -3.163 1.00 0.00 H new ATOM 0 HD22 LEU A 60 10.424 -7.872 -2.957 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.848 -8.423 -3.571 1.00 0.00 H new ATOM 971 N LEU A 61 8.143 -4.543 -5.476 1.00 0.00 N ATOM 972 CA LEU A 61 7.880 -3.169 -5.990 1.00 0.00 C ATOM 973 C LEU A 61 9.205 -2.467 -6.299 1.00 0.00 C ATOM 974 O LEU A 61 10.191 -2.629 -5.604 1.00 0.00 O ATOM 975 CB LEU A 61 7.101 -2.381 -4.930 1.00 0.00 C ATOM 976 CG LEU A 61 5.614 -2.735 -5.015 1.00 0.00 C ATOM 977 CD1 LEU A 61 5.435 -4.245 -4.840 1.00 0.00 C ATOM 978 CD2 LEU A 61 4.852 -1.999 -3.914 1.00 0.00 C ATOM 0 H LEU A 61 8.072 -4.643 -4.463 1.00 0.00 H new ATOM 0 HA LEU A 61 7.293 -3.225 -6.907 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.484 -2.613 -3.936 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.240 -1.311 -5.083 1.00 0.00 H new ATOM 0 HG LEU A 61 5.225 -2.436 -5.988 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.376 -4.495 -4.901 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.977 -4.769 -5.627 1.00 0.00 H new ATOM 0 HD13 LEU A 61 5.824 -4.547 -3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 61 3.793 -2.250 -3.974 1.00 0.00 H new ATOM 0 HD22 LEU A 61 5.241 -2.297 -2.940 1.00 0.00 H new ATOM 0 HD23 LEU A 61 4.977 -0.924 -4.041 1.00 0.00 H new ATOM 990 N GLU A 62 9.229 -1.688 -7.346 1.00 0.00 N ATOM 991 CA GLU A 62 10.480 -0.973 -7.725 1.00 0.00 C ATOM 992 C GLU A 62 10.586 0.348 -6.959 1.00 0.00 C ATOM 993 O GLU A 62 9.619 1.066 -6.779 1.00 0.00 O ATOM 994 CB GLU A 62 10.467 -0.693 -9.227 1.00 0.00 C ATOM 995 CG GLU A 62 11.794 -0.054 -9.635 1.00 0.00 C ATOM 996 CD GLU A 62 11.817 0.176 -11.147 1.00 0.00 C ATOM 997 OE1 GLU A 62 10.972 -0.383 -11.826 1.00 0.00 O ATOM 998 OE2 GLU A 62 12.684 0.906 -11.600 1.00 0.00 O ATOM 0 H GLU A 62 8.431 -1.516 -7.958 1.00 0.00 H new ATOM 0 HA GLU A 62 11.338 -1.597 -7.474 1.00 0.00 H new ATOM 0 HB2 GLU A 62 10.312 -1.620 -9.780 1.00 0.00 H new ATOM 0 HB3 GLU A 62 9.639 -0.030 -9.477 1.00 0.00 H new ATOM 0 HG2 GLU A 62 11.928 0.893 -9.112 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.623 -0.699 -9.344 1.00 0.00 H new ATOM 1005 N GLN A 63 11.767 0.657 -6.501 1.00 0.00 N ATOM 1006 CA GLN A 63 11.986 1.911 -5.729 1.00 0.00 C ATOM 1007 C GLN A 63 11.979 3.137 -6.645 1.00 0.00 C ATOM 1008 O GLN A 63 12.573 3.148 -7.706 1.00 0.00 O ATOM 1009 CB GLN A 63 13.334 1.827 -5.015 1.00 0.00 C ATOM 1010 CG GLN A 63 13.577 3.115 -4.225 1.00 0.00 C ATOM 1011 CD GLN A 63 14.820 2.957 -3.345 1.00 0.00 C ATOM 1012 OE1 GLN A 63 15.253 1.853 -3.077 1.00 0.00 O ATOM 1013 NE2 GLN A 63 15.415 4.022 -2.883 1.00 0.00 N ATOM 0 H GLN A 63 12.601 0.085 -6.631 1.00 0.00 H new ATOM 0 HA GLN A 63 11.175 2.018 -5.008 1.00 0.00 H new ATOM 0 HB2 GLN A 63 13.349 0.968 -4.344 1.00 0.00 H new ATOM 0 HB3 GLN A 63 14.133 1.677 -5.741 1.00 0.00 H new ATOM 0 HG2 GLN A 63 13.709 3.953 -4.910 1.00 0.00 H new ATOM 0 HG3 GLN A 63 12.709 3.342 -3.606 1.00 0.00 H new ATOM 0 HE21 GLN A 63 15.051 4.948 -3.108 1.00 0.00 H new ATOM 0 HE22 GLN A 63 16.244 3.929 -2.296 1.00 0.00 H new ATOM 1022 N GLY A 64 11.322 4.182 -6.216 1.00 0.00 N ATOM 1023 CA GLY A 64 11.275 5.432 -7.024 1.00 0.00 C ATOM 1024 C GLY A 64 10.165 5.339 -8.068 1.00 0.00 C ATOM 1025 O GLY A 64 10.177 6.042 -9.061 1.00 0.00 O ATOM 0 H GLY A 64 10.812 4.222 -5.333 1.00 0.00 H new ATOM 0 HA2 GLY A 64 11.102 6.289 -6.373 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.235 5.593 -7.515 1.00 0.00 H new ATOM 1029 N GLU A 65 9.205 4.474 -7.856 1.00 0.00 N ATOM 1030 CA GLU A 65 8.084 4.325 -8.838 1.00 0.00 C ATOM 1031 C GLU A 65 6.736 4.425 -8.119 1.00 0.00 C ATOM 1032 O GLU A 65 6.580 4.010 -6.982 1.00 0.00 O ATOM 1033 CB GLU A 65 8.198 2.968 -9.535 1.00 0.00 C ATOM 1034 CG GLU A 65 9.475 2.927 -10.382 1.00 0.00 C ATOM 1035 CD GLU A 65 9.381 3.952 -11.517 1.00 0.00 C ATOM 1036 OE1 GLU A 65 8.274 4.357 -11.833 1.00 0.00 O ATOM 1037 OE2 GLU A 65 10.417 4.316 -12.048 1.00 0.00 O ATOM 0 H GLU A 65 9.148 3.862 -7.042 1.00 0.00 H new ATOM 0 HA GLU A 65 8.147 5.123 -9.578 1.00 0.00 H new ATOM 0 HB2 GLU A 65 8.216 2.168 -8.794 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.326 2.798 -10.166 1.00 0.00 H new ATOM 0 HG2 GLU A 65 10.343 3.141 -9.758 1.00 0.00 H new ATOM 0 HG3 GLU A 65 9.617 1.928 -10.794 1.00 0.00 H new ATOM 1044 N SER A 66 5.766 4.994 -8.788 1.00 0.00 N ATOM 1045 CA SER A 66 4.414 5.154 -8.188 1.00 0.00 C ATOM 1046 C SER A 66 3.607 3.869 -8.357 1.00 0.00 C ATOM 1047 O SER A 66 3.711 3.175 -9.353 1.00 0.00 O ATOM 1048 CB SER A 66 3.690 6.312 -8.874 1.00 0.00 C ATOM 1049 OG SER A 66 4.186 7.538 -8.356 1.00 0.00 O ATOM 0 H SER A 66 5.858 5.358 -9.736 1.00 0.00 H new ATOM 0 HA SER A 66 4.517 5.366 -7.124 1.00 0.00 H new ATOM 0 HB2 SER A 66 3.846 6.268 -9.952 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.616 6.238 -8.704 1.00 0.00 H new ATOM 0 HG SER A 66 3.785 8.286 -8.846 1.00 0.00 H new ATOM 1055 N TYR A 67 2.793 3.554 -7.384 1.00 0.00 N ATOM 1056 CA TYR A 67 1.960 2.320 -7.463 1.00 0.00 C ATOM 1057 C TYR A 67 0.555 2.610 -6.956 1.00 0.00 C ATOM 1058 O TYR A 67 0.341 3.438 -6.079 1.00 0.00 O ATOM 1059 CB TYR A 67 2.585 1.222 -6.607 1.00 0.00 C ATOM 1060 CG TYR A 67 3.864 0.757 -7.255 1.00 0.00 C ATOM 1061 CD1 TYR A 67 3.810 -0.116 -8.347 1.00 0.00 C ATOM 1062 CD2 TYR A 67 5.098 1.193 -6.765 1.00 0.00 C ATOM 1063 CE1 TYR A 67 4.994 -0.553 -8.951 1.00 0.00 C ATOM 1064 CE2 TYR A 67 6.284 0.756 -7.368 1.00 0.00 C ATOM 1065 CZ TYR A 67 6.231 -0.118 -8.460 1.00 0.00 C ATOM 1066 OH TYR A 67 7.398 -0.550 -9.056 1.00 0.00 O ATOM 0 H TYR A 67 2.669 4.103 -6.533 1.00 0.00 H new ATOM 0 HA TYR A 67 1.911 1.992 -8.501 1.00 0.00 H new ATOM 0 HB2 TYR A 67 2.787 1.597 -5.604 1.00 0.00 H new ATOM 0 HB3 TYR A 67 1.892 0.387 -6.502 1.00 0.00 H new ATOM 0 HD1 TYR A 67 2.855 -0.452 -8.723 1.00 0.00 H new ATOM 0 HD2 TYR A 67 5.137 1.867 -5.922 1.00 0.00 H new ATOM 0 HE1 TYR A 67 4.954 -1.225 -9.795 1.00 0.00 H new ATOM 0 HE2 TYR A 67 7.238 1.093 -6.991 1.00 0.00 H new ATOM 0 HH TYR A 67 7.481 -0.144 -9.944 1.00 0.00 H new ATOM 1076 N LEU A 68 -0.406 1.910 -7.503 1.00 0.00 N ATOM 1077 CA LEU A 68 -1.823 2.086 -7.085 1.00 0.00 C ATOM 1078 C LEU A 68 -2.240 0.876 -6.259 1.00 0.00 C ATOM 1079 O LEU A 68 -2.168 -0.257 -6.712 1.00 0.00 O ATOM 1080 CB LEU A 68 -2.706 2.191 -8.333 1.00 0.00 C ATOM 1081 CG LEU A 68 -4.194 2.194 -7.950 1.00 0.00 C ATOM 1082 CD1 LEU A 68 -4.482 3.316 -6.950 1.00 0.00 C ATOM 1083 CD2 LEU A 68 -5.034 2.412 -9.212 1.00 0.00 C ATOM 0 H LEU A 68 -0.262 1.213 -8.234 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.933 2.993 -6.491 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.465 3.103 -8.879 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.500 1.355 -9.001 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.448 1.238 -7.491 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.540 3.307 -6.687 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.884 3.165 -6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.228 4.277 -7.398 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.092 2.415 -8.949 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.770 3.368 -9.665 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.839 1.608 -9.922 1.00 0.00 H new ATOM 1095 N LEU A 69 -2.678 1.115 -5.049 1.00 0.00 N ATOM 1096 CA LEU A 69 -3.116 0.006 -4.155 1.00 0.00 C ATOM 1097 C LEU A 69 -4.639 -0.056 -4.163 1.00 0.00 C ATOM 1098 O LEU A 69 -5.311 0.947 -3.999 1.00 0.00 O ATOM 1099 CB LEU A 69 -2.624 0.280 -2.733 1.00 0.00 C ATOM 1100 CG LEU A 69 -1.108 0.502 -2.749 1.00 0.00 C ATOM 1101 CD1 LEU A 69 -0.617 0.769 -1.323 1.00 0.00 C ATOM 1102 CD2 LEU A 69 -0.401 -0.738 -3.316 1.00 0.00 C ATOM 0 H LEU A 69 -2.751 2.046 -4.639 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.704 -0.941 -4.503 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -3.126 1.158 -2.326 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.872 -0.559 -2.083 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.878 1.360 -3.380 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.461 0.927 -1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.110 1.657 -0.929 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.852 -0.087 -0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.676 -0.571 -3.324 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.630 -1.603 -2.694 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.747 -0.921 -4.333 1.00 0.00 H new ATOM 1114 N ARG A 70 -5.189 -1.225 -4.375 1.00 0.00 N ATOM 1115 CA ARG A 70 -6.678 -1.367 -4.424 1.00 0.00 C ATOM 1116 C ARG A 70 -7.152 -2.435 -3.437 1.00 0.00 C ATOM 1117 O ARG A 70 -6.526 -3.464 -3.253 1.00 0.00 O ATOM 1118 CB ARG A 70 -7.095 -1.774 -5.837 1.00 0.00 C ATOM 1119 CG ARG A 70 -6.641 -0.697 -6.827 1.00 0.00 C ATOM 1120 CD ARG A 70 -7.232 -0.980 -8.212 1.00 0.00 C ATOM 1121 NE ARG A 70 -6.680 -2.265 -8.741 1.00 0.00 N ATOM 1122 CZ ARG A 70 -7.111 -2.760 -9.873 1.00 0.00 C ATOM 1123 NH1 ARG A 70 -8.039 -2.146 -10.556 1.00 0.00 N ATOM 1124 NH2 ARG A 70 -6.611 -3.880 -10.321 1.00 0.00 N ATOM 0 H ARG A 70 -4.669 -2.091 -4.517 1.00 0.00 H new ATOM 0 HA ARG A 70 -7.130 -0.413 -4.154 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -6.651 -2.735 -6.097 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -8.177 -1.899 -5.888 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -6.960 0.286 -6.480 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -5.553 -0.678 -6.883 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -8.319 -1.038 -8.150 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -6.995 -0.163 -8.893 1.00 0.00 H new ATOM 0 HE ARG A 70 -5.961 -2.760 -8.214 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -8.435 -1.273 -10.208 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -8.368 -2.540 -11.437 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -5.888 -4.365 -9.789 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -6.943 -4.270 -11.203 1.00 0.00 H new ATOM 1138 N SER A 71 -8.277 -2.180 -2.824 1.00 0.00 N ATOM 1139 CA SER A 71 -8.875 -3.136 -1.848 1.00 0.00 C ATOM 1140 C SER A 71 -7.848 -3.562 -0.797 1.00 0.00 C ATOM 1141 O SER A 71 -7.562 -4.734 -0.634 1.00 0.00 O ATOM 1142 CB SER A 71 -9.404 -4.367 -2.587 1.00 0.00 C ATOM 1143 OG SER A 71 -10.037 -5.236 -1.656 1.00 0.00 O ATOM 0 H SER A 71 -8.819 -1.327 -2.963 1.00 0.00 H new ATOM 0 HA SER A 71 -9.698 -2.635 -1.338 1.00 0.00 H new ATOM 0 HB2 SER A 71 -10.111 -4.066 -3.360 1.00 0.00 H new ATOM 0 HB3 SER A 71 -8.586 -4.885 -3.088 1.00 0.00 H new ATOM 0 HG SER A 71 -9.523 -6.067 -1.583 1.00 0.00 H new ATOM 1149 N VAL A 72 -7.309 -2.618 -0.062 1.00 0.00 N ATOM 1150 CA VAL A 72 -6.313 -2.952 1.007 1.00 0.00 C ATOM 1151 C VAL A 72 -6.922 -2.679 2.378 1.00 0.00 C ATOM 1152 O VAL A 72 -7.891 -1.950 2.507 1.00 0.00 O ATOM 1153 CB VAL A 72 -5.047 -2.106 0.840 1.00 0.00 C ATOM 1154 CG1 VAL A 72 -4.245 -2.630 -0.347 1.00 0.00 C ATOM 1155 CG2 VAL A 72 -5.427 -0.643 0.594 1.00 0.00 C ATOM 0 H VAL A 72 -7.518 -1.624 -0.157 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.051 -4.007 0.922 1.00 0.00 H new ATOM 0 HB VAL A 72 -4.447 -2.171 1.748 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -3.343 -2.031 -0.470 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -3.969 -3.669 -0.169 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -4.849 -2.565 -1.252 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -4.522 -0.047 0.476 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.030 -0.571 -0.311 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -6.000 -0.268 1.442 1.00 0.00 H new ATOM 1165 N VAL A 73 -6.352 -3.271 3.403 1.00 0.00 N ATOM 1166 CA VAL A 73 -6.872 -3.085 4.792 1.00 0.00 C ATOM 1167 C VAL A 73 -5.795 -2.435 5.660 1.00 0.00 C ATOM 1168 O VAL A 73 -4.639 -2.815 5.637 1.00 0.00 O ATOM 1169 CB VAL A 73 -7.258 -4.448 5.378 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -6.005 -5.292 5.648 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -8.010 -4.228 6.689 1.00 0.00 C ATOM 0 H VAL A 73 -5.539 -3.882 3.332 1.00 0.00 H new ATOM 0 HA VAL A 73 -7.750 -2.440 4.769 1.00 0.00 H new ATOM 0 HB VAL A 73 -7.889 -4.977 4.664 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -6.298 -6.256 6.064 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -5.464 -5.449 4.715 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.362 -4.772 6.357 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -8.289 -5.192 7.114 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -7.369 -3.694 7.391 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -8.909 -3.641 6.499 1.00 0.00 H new ATOM 1181 N VAL A 74 -6.175 -1.443 6.424 1.00 0.00 N ATOM 1182 CA VAL A 74 -5.193 -0.741 7.296 1.00 0.00 C ATOM 1183 C VAL A 74 -5.070 -1.475 8.630 1.00 0.00 C ATOM 1184 O VAL A 74 -5.997 -1.535 9.418 1.00 0.00 O ATOM 1185 CB VAL A 74 -5.663 0.692 7.533 1.00 0.00 C ATOM 1186 CG1 VAL A 74 -4.526 1.504 8.152 1.00 0.00 C ATOM 1187 CG2 VAL A 74 -6.064 1.320 6.193 1.00 0.00 C ATOM 0 H VAL A 74 -7.130 -1.089 6.480 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.218 -0.726 6.809 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.518 0.690 8.209 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.860 2.527 8.322 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.234 1.056 9.102 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.672 1.509 7.475 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.400 2.344 6.357 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.205 1.323 5.521 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.872 0.740 5.746 1.00 0.00 H new ATOM 1197 N GLY A 75 -3.919 -2.041 8.883 1.00 0.00 N ATOM 1198 CA GLY A 75 -3.697 -2.789 10.153 1.00 0.00 C ATOM 1199 C GLY A 75 -3.149 -1.850 11.227 1.00 0.00 C ATOM 1200 O GLY A 75 -2.373 -0.955 10.957 1.00 0.00 O ATOM 0 H GLY A 75 -3.115 -2.016 8.256 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.633 -3.233 10.491 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -2.998 -3.608 9.984 1.00 0.00 H new ATOM 1204 N GLU A 76 -3.555 -2.059 12.447 1.00 0.00 N ATOM 1205 CA GLU A 76 -3.081 -1.195 13.563 1.00 0.00 C ATOM 1206 C GLU A 76 -1.570 -1.333 13.735 1.00 0.00 C ATOM 1207 O GLU A 76 -1.032 -2.424 13.773 1.00 0.00 O ATOM 1208 CB GLU A 76 -3.795 -1.622 14.849 1.00 0.00 C ATOM 1209 CG GLU A 76 -3.481 -3.091 15.158 1.00 0.00 C ATOM 1210 CD GLU A 76 -4.394 -3.583 16.287 1.00 0.00 C ATOM 1211 OE1 GLU A 76 -5.571 -3.264 16.252 1.00 0.00 O ATOM 1212 OE2 GLU A 76 -3.900 -4.273 17.165 1.00 0.00 O ATOM 0 H GLU A 76 -4.201 -2.799 12.722 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.306 -0.152 13.340 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -3.477 -0.991 15.679 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -4.871 -1.486 14.740 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -3.627 -3.700 14.266 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -2.436 -3.197 15.449 1.00 0.00 H new ATOM 1219 N TYR A 77 -0.876 -0.226 13.838 1.00 0.00 N ATOM 1220 CA TYR A 77 0.601 -0.279 14.009 1.00 0.00 C ATOM 1221 C TYR A 77 1.016 0.747 15.062 1.00 0.00 C ATOM 1222 O TYR A 77 1.176 1.917 14.777 1.00 0.00 O ATOM 1223 CB TYR A 77 1.270 0.032 12.671 1.00 0.00 C ATOM 1224 CG TYR A 77 2.737 -0.316 12.747 1.00 0.00 C ATOM 1225 CD1 TYR A 77 3.127 -1.651 12.915 1.00 0.00 C ATOM 1226 CD2 TYR A 77 3.707 0.691 12.660 1.00 0.00 C ATOM 1227 CE1 TYR A 77 4.484 -1.979 12.996 1.00 0.00 C ATOM 1228 CE2 TYR A 77 5.065 0.361 12.743 1.00 0.00 C ATOM 1229 CZ TYR A 77 5.452 -0.973 12.910 1.00 0.00 C ATOM 1230 OH TYR A 77 6.790 -1.299 12.990 1.00 0.00 O ATOM 0 H TYR A 77 -1.274 0.713 13.810 1.00 0.00 H new ATOM 0 HA TYR A 77 0.910 -1.271 14.337 1.00 0.00 H new ATOM 0 HB2 TYR A 77 0.792 -0.536 11.873 1.00 0.00 H new ATOM 0 HB3 TYR A 77 1.148 1.088 12.428 1.00 0.00 H new ATOM 0 HD1 TYR A 77 2.379 -2.427 12.982 1.00 0.00 H new ATOM 0 HD2 TYR A 77 3.408 1.720 12.529 1.00 0.00 H new ATOM 0 HE1 TYR A 77 4.784 -3.008 13.125 1.00 0.00 H new ATOM 0 HE2 TYR A 77 5.814 1.136 12.678 1.00 0.00 H new ATOM 0 HH TYR A 77 7.330 -0.485 12.912 1.00 0.00 H new ATOM 1240 N ASN A 78 1.181 0.302 16.278 1.00 0.00 N ATOM 1241 CA ASN A 78 1.584 1.215 17.390 1.00 0.00 C ATOM 1242 C ASN A 78 0.800 2.532 17.328 1.00 0.00 C ATOM 1243 O ASN A 78 -0.376 2.560 17.022 1.00 0.00 O ATOM 1244 CB ASN A 78 3.092 1.501 17.311 1.00 0.00 C ATOM 1245 CG ASN A 78 3.428 2.228 16.006 1.00 0.00 C ATOM 1246 OD1 ASN A 78 3.026 3.357 15.801 1.00 0.00 O ATOM 1247 ND2 ASN A 78 4.157 1.624 15.112 1.00 0.00 N ATOM 0 H ASN A 78 1.052 -0.671 16.554 1.00 0.00 H new ATOM 0 HA ASN A 78 1.357 0.724 18.336 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.399 2.108 18.163 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.650 0.566 17.368 1.00 0.00 H new ATOM 0 HD21 ASN A 78 4.391 2.098 14.240 1.00 0.00 H new ATOM 0 HD22 ASN A 78 4.494 0.677 15.284 1.00 0.00 H new ATOM 1254 N ASP A 79 1.450 3.621 17.630 1.00 0.00 N ATOM 1255 CA ASP A 79 0.766 4.940 17.604 1.00 0.00 C ATOM 1256 C ASP A 79 0.531 5.353 16.151 1.00 0.00 C ATOM 1257 O ASP A 79 -0.044 6.388 15.870 1.00 0.00 O ATOM 1258 CB ASP A 79 1.655 5.971 18.301 1.00 0.00 C ATOM 1259 CG ASP A 79 0.871 7.264 18.524 1.00 0.00 C ATOM 1260 OD1 ASP A 79 -0.346 7.214 18.456 1.00 0.00 O ATOM 1261 OD2 ASP A 79 1.500 8.282 18.761 1.00 0.00 O ATOM 0 H ASP A 79 2.434 3.652 17.896 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.193 4.879 18.119 1.00 0.00 H new ATOM 0 HB2 ASP A 79 2.004 5.577 19.256 1.00 0.00 H new ATOM 0 HB3 ASP A 79 2.539 6.171 17.696 1.00 0.00 H new ATOM 1266 N ARG A 80 0.991 4.550 15.227 1.00 0.00 N ATOM 1267 CA ARG A 80 0.827 4.871 13.776 1.00 0.00 C ATOM 1268 C ARG A 80 -0.064 3.831 13.103 1.00 0.00 C ATOM 1269 O ARG A 80 -0.668 2.985 13.742 1.00 0.00 O ATOM 1270 CB ARG A 80 2.202 4.863 13.106 1.00 0.00 C ATOM 1271 CG ARG A 80 3.115 5.904 13.766 1.00 0.00 C ATOM 1272 CD ARG A 80 2.737 7.314 13.296 1.00 0.00 C ATOM 1273 NE ARG A 80 3.749 8.293 13.790 1.00 0.00 N ATOM 1274 CZ ARG A 80 3.406 9.531 14.036 1.00 0.00 C ATOM 1275 NH1 ARG A 80 2.176 9.930 13.846 1.00 0.00 N ATOM 1276 NH2 ARG A 80 4.301 10.374 14.464 1.00 0.00 N ATOM 0 H ARG A 80 1.479 3.675 15.418 1.00 0.00 H new ATOM 0 HA ARG A 80 0.364 5.853 13.676 1.00 0.00 H new ATOM 0 HB2 ARG A 80 2.649 3.872 13.187 1.00 0.00 H new ATOM 0 HB3 ARG A 80 2.099 5.080 12.043 1.00 0.00 H new ATOM 0 HG2 ARG A 80 3.028 5.839 14.851 1.00 0.00 H new ATOM 0 HG3 ARG A 80 4.155 5.696 13.516 1.00 0.00 H new ATOM 0 HD2 ARG A 80 2.687 7.345 12.208 1.00 0.00 H new ATOM 0 HD3 ARG A 80 1.747 7.579 13.668 1.00 0.00 H new ATOM 0 HE ARG A 80 4.713 7.995 13.937 1.00 0.00 H new ATOM 0 HH11 ARG A 80 1.474 9.274 13.503 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.918 10.897 14.041 1.00 0.00 H new ATOM 0 HH21 ARG A 80 5.264 10.068 14.606 1.00 0.00 H new ATOM 0 HH22 ARG A 80 4.040 11.341 14.658 1.00 0.00 H new ATOM 1290 N PHE A 81 -0.155 3.905 11.800 1.00 0.00 N ATOM 1291 CA PHE A 81 -1.011 2.952 11.035 1.00 0.00 C ATOM 1292 C PHE A 81 -0.198 2.308 9.916 1.00 0.00 C ATOM 1293 O PHE A 81 0.790 2.847 9.456 1.00 0.00 O ATOM 1294 CB PHE A 81 -2.191 3.714 10.436 1.00 0.00 C ATOM 1295 CG PHE A 81 -3.094 4.177 11.552 1.00 0.00 C ATOM 1296 CD1 PHE A 81 -4.087 3.323 12.042 1.00 0.00 C ATOM 1297 CD2 PHE A 81 -2.937 5.457 12.100 1.00 0.00 C ATOM 1298 CE1 PHE A 81 -4.926 3.746 13.078 1.00 0.00 C ATOM 1299 CE2 PHE A 81 -3.777 5.880 13.137 1.00 0.00 C ATOM 1300 CZ PHE A 81 -4.771 5.025 13.626 1.00 0.00 C ATOM 0 H PHE A 81 0.334 4.594 11.228 1.00 0.00 H new ATOM 0 HA PHE A 81 -1.375 2.172 11.703 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -1.834 4.569 9.861 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -2.742 3.074 9.747 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -4.206 2.336 11.620 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -2.169 6.116 11.723 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -5.693 3.086 13.455 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -3.658 6.867 13.560 1.00 0.00 H new ATOM 0 HZ PHE A 81 -5.419 5.352 14.426 1.00 0.00 H new ATOM 1310 N GLN A 82 -0.607 1.146 9.482 1.00 0.00 N ATOM 1311 CA GLN A 82 0.135 0.442 8.396 1.00 0.00 C ATOM 1312 C GLN A 82 -0.856 -0.203 7.428 1.00 0.00 C ATOM 1313 O GLN A 82 -1.955 -0.572 7.797 1.00 0.00 O ATOM 1314 CB GLN A 82 1.020 -0.644 9.012 1.00 0.00 C ATOM 1315 CG GLN A 82 1.847 -1.315 7.912 1.00 0.00 C ATOM 1316 CD GLN A 82 2.748 -2.391 8.515 1.00 0.00 C ATOM 1317 OE1 GLN A 82 2.269 -3.363 9.071 1.00 0.00 O ATOM 1318 NE2 GLN A 82 4.042 -2.260 8.427 1.00 0.00 N ATOM 0 H GLN A 82 -1.427 0.652 9.835 1.00 0.00 H new ATOM 0 HA GLN A 82 0.752 1.160 7.855 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.679 -0.208 9.762 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.403 -1.385 9.521 1.00 0.00 H new ATOM 0 HG2 GLN A 82 1.185 -1.759 7.168 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.453 -0.570 7.396 1.00 0.00 H new ATOM 0 HE21 GLN A 82 4.442 -1.445 7.961 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.655 -2.972 8.824 1.00 0.00 H new ATOM 1327 N VAL A 83 -0.460 -0.352 6.188 1.00 0.00 N ATOM 1328 CA VAL A 83 -1.346 -0.987 5.165 1.00 0.00 C ATOM 1329 C VAL A 83 -0.792 -2.363 4.811 1.00 0.00 C ATOM 1330 O VAL A 83 0.388 -2.531 4.570 1.00 0.00 O ATOM 1331 CB VAL A 83 -1.406 -0.104 3.914 1.00 0.00 C ATOM 1332 CG1 VAL A 83 -2.326 1.090 4.187 1.00 0.00 C ATOM 1333 CG2 VAL A 83 -0.002 0.404 3.565 1.00 0.00 C ATOM 0 H VAL A 83 0.451 -0.057 5.837 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.354 -1.096 5.565 1.00 0.00 H new ATOM 0 HB VAL A 83 -1.792 -0.687 3.078 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -2.373 1.723 3.301 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.326 0.731 4.430 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.934 1.667 5.024 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.053 1.031 2.675 1.00 0.00 H new ATOM 0 HG22 VAL A 83 0.391 0.987 4.398 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.655 -0.445 3.374 1.00 0.00 H new ATOM 1343 N GLN A 84 -1.643 -3.358 4.799 1.00 0.00 N ATOM 1344 CA GLN A 84 -1.193 -4.749 4.487 1.00 0.00 C ATOM 1345 C GLN A 84 -1.644 -5.146 3.084 1.00 0.00 C ATOM 1346 O GLN A 84 -2.807 -5.062 2.737 1.00 0.00 O ATOM 1347 CB GLN A 84 -1.807 -5.709 5.506 1.00 0.00 C ATOM 1348 CG GLN A 84 -1.179 -5.458 6.879 1.00 0.00 C ATOM 1349 CD GLN A 84 -1.824 -6.381 7.914 1.00 0.00 C ATOM 1350 OE1 GLN A 84 -2.628 -7.227 7.576 1.00 0.00 O ATOM 1351 NE2 GLN A 84 -1.506 -6.249 9.172 1.00 0.00 N ATOM 0 H GLN A 84 -2.640 -3.265 4.994 1.00 0.00 H new ATOM 0 HA GLN A 84 -0.105 -4.795 4.535 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -2.886 -5.564 5.555 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -1.637 -6.741 5.199 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -0.105 -5.637 6.837 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -1.318 -4.416 7.169 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -0.831 -5.539 9.456 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -1.932 -6.856 9.872 1.00 0.00 H new ATOM 1360 N VAL A 85 -0.719 -5.593 2.277 1.00 0.00 N ATOM 1361 CA VAL A 85 -1.061 -6.022 0.890 1.00 0.00 C ATOM 1362 C VAL A 85 -1.271 -7.534 0.876 1.00 0.00 C ATOM 1363 O VAL A 85 -0.484 -8.290 1.425 1.00 0.00 O ATOM 1364 CB VAL A 85 0.077 -5.651 -0.059 1.00 0.00 C ATOM 1365 CG1 VAL A 85 -0.359 -5.902 -1.505 1.00 0.00 C ATOM 1366 CG2 VAL A 85 0.420 -4.171 0.122 1.00 0.00 C ATOM 0 H VAL A 85 0.267 -5.680 2.522 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.972 -5.521 0.564 1.00 0.00 H new ATOM 0 HB VAL A 85 0.953 -6.260 0.164 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.454 -5.637 -2.181 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.608 -6.956 -1.632 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.234 -5.292 -1.732 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.232 -3.900 -0.553 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.457 -3.564 -0.103 1.00 0.00 H new ATOM 0 HG23 VAL A 85 0.730 -3.993 1.152 1.00 0.00 H new ATOM 1376 N ASN A 86 -2.336 -7.980 0.263 1.00 0.00 N ATOM 1377 CA ASN A 86 -2.627 -9.443 0.217 1.00 0.00 C ATOM 1378 C ASN A 86 -3.143 -9.840 -1.168 1.00 0.00 C ATOM 1379 O ASN A 86 -3.246 -9.032 -2.071 1.00 0.00 O ATOM 1380 CB ASN A 86 -3.690 -9.779 1.271 1.00 0.00 C ATOM 1381 CG ASN A 86 -4.865 -8.802 1.164 1.00 0.00 C ATOM 1382 OD1 ASN A 86 -5.194 -8.337 0.089 1.00 0.00 O ATOM 1383 ND2 ASN A 86 -5.518 -8.469 2.246 1.00 0.00 N ATOM 0 H ASN A 86 -3.020 -7.390 -0.210 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.710 -9.994 0.423 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -4.043 -10.801 1.130 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -3.253 -9.727 2.268 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -6.303 -7.820 2.189 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -5.243 -8.858 3.148 1.00 0.00 H new ATOM 1390 N LYS A 87 -3.470 -11.092 -1.325 1.00 0.00 N ATOM 1391 CA LYS A 87 -3.986 -11.596 -2.631 1.00 0.00 C ATOM 1392 C LYS A 87 -5.228 -10.802 -3.047 1.00 0.00 C ATOM 1393 O LYS A 87 -5.412 -10.470 -4.203 1.00 0.00 O ATOM 1394 CB LYS A 87 -4.363 -13.072 -2.465 1.00 0.00 C ATOM 1395 CG LYS A 87 -4.907 -13.624 -3.783 1.00 0.00 C ATOM 1396 CD LYS A 87 -5.204 -15.120 -3.630 1.00 0.00 C ATOM 1397 CE LYS A 87 -5.741 -15.674 -4.952 1.00 0.00 C ATOM 1398 NZ LYS A 87 -4.682 -15.586 -5.997 1.00 0.00 N ATOM 0 H LYS A 87 -3.401 -11.799 -0.593 1.00 0.00 H new ATOM 0 HA LYS A 87 -3.220 -11.481 -3.398 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -3.490 -13.646 -2.153 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.112 -13.179 -1.680 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.814 -13.090 -4.066 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.182 -13.467 -4.582 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.298 -15.653 -3.342 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.933 -15.277 -2.835 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.054 -16.710 -4.823 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.621 -15.111 -5.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.911 -16.232 -6.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.630 -14.612 -6.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -3.765 -15.853 -5.585 1.00 0.00 H new ATOM 1412 N ASN A 88 -6.078 -10.500 -2.116 1.00 0.00 N ATOM 1413 CA ASN A 88 -7.312 -9.732 -2.444 1.00 0.00 C ATOM 1414 C ASN A 88 -6.936 -8.368 -3.034 1.00 0.00 C ATOM 1415 O ASN A 88 -7.587 -7.867 -3.932 1.00 0.00 O ATOM 1416 CB ASN A 88 -8.122 -9.530 -1.161 1.00 0.00 C ATOM 1417 CG ASN A 88 -9.292 -8.570 -1.415 1.00 0.00 C ATOM 1418 OD1 ASN A 88 -9.218 -7.402 -1.083 1.00 0.00 O ATOM 1419 ND2 ASN A 88 -10.378 -9.016 -1.986 1.00 0.00 N ATOM 0 H ASN A 88 -5.975 -10.752 -1.133 1.00 0.00 H new ATOM 0 HA ASN A 88 -7.903 -10.282 -3.176 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.500 -10.489 -0.807 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.479 -9.131 -0.376 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.162 -8.386 -2.153 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.442 -9.995 -2.265 1.00 0.00 H new ATOM 1426 N SER A 89 -5.904 -7.754 -2.530 1.00 0.00 N ATOM 1427 CA SER A 89 -5.509 -6.416 -3.056 1.00 0.00 C ATOM 1428 C SER A 89 -4.821 -6.547 -4.413 1.00 0.00 C ATOM 1429 O SER A 89 -4.361 -7.605 -4.799 1.00 0.00 O ATOM 1430 CB SER A 89 -4.555 -5.737 -2.076 1.00 0.00 C ATOM 1431 OG SER A 89 -3.238 -6.231 -2.281 1.00 0.00 O ATOM 0 H SER A 89 -5.317 -8.118 -1.779 1.00 0.00 H new ATOM 0 HA SER A 89 -6.411 -5.816 -3.174 1.00 0.00 H new ATOM 0 HB2 SER A 89 -4.577 -4.657 -2.220 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.872 -5.929 -1.051 1.00 0.00 H new ATOM 0 HG SER A 89 -3.240 -7.208 -2.206 1.00 0.00 H new ATOM 1437 N SER A 90 -4.749 -5.460 -5.138 1.00 0.00 N ATOM 1438 CA SER A 90 -4.090 -5.474 -6.481 1.00 0.00 C ATOM 1439 C SER A 90 -3.118 -4.302 -6.573 1.00 0.00 C ATOM 1440 O SER A 90 -3.314 -3.270 -5.959 1.00 0.00 O ATOM 1441 CB SER A 90 -5.154 -5.340 -7.566 1.00 0.00 C ATOM 1442 OG SER A 90 -5.959 -6.510 -7.572 1.00 0.00 O ATOM 0 H SER A 90 -5.122 -4.554 -4.855 1.00 0.00 H new ATOM 0 HA SER A 90 -3.548 -6.410 -6.617 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.770 -4.460 -7.382 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.684 -5.202 -8.539 1.00 0.00 H new ATOM 0 HG SER A 90 -6.646 -6.431 -8.266 1.00 0.00 H new ATOM 1448 N ILE A 91 -2.063 -4.459 -7.331 1.00 0.00 N ATOM 1449 CA ILE A 91 -1.053 -3.365 -7.474 1.00 0.00 C ATOM 1450 C ILE A 91 -0.803 -3.087 -8.951 1.00 0.00 C ATOM 1451 O ILE A 91 -0.605 -3.991 -9.739 1.00 0.00 O ATOM 1452 CB ILE A 91 0.246 -3.795 -6.802 1.00 0.00 C ATOM 1453 CG1 ILE A 91 -0.006 -3.946 -5.299 1.00 0.00 C ATOM 1454 CG2 ILE A 91 1.319 -2.732 -7.041 1.00 0.00 C ATOM 1455 CD1 ILE A 91 1.203 -4.595 -4.612 1.00 0.00 C ATOM 0 H ILE A 91 -1.856 -5.305 -7.862 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.426 -2.457 -7.001 1.00 0.00 H new ATOM 0 HB ILE A 91 0.586 -4.744 -7.217 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.201 -2.969 -4.857 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.895 -4.554 -5.133 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.248 -3.039 -6.561 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.485 -2.617 -8.112 1.00 0.00 H new ATOM 0 HG23 ILE A 91 0.990 -1.782 -6.621 1.00 0.00 H new ATOM 0 HD11 ILE A 91 1.005 -4.694 -3.545 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.379 -5.581 -5.041 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.084 -3.971 -4.761 1.00 0.00 H new ATOM 1467 N GLU A 92 -0.824 -1.831 -9.334 1.00 0.00 N ATOM 1468 CA GLU A 92 -0.597 -1.472 -10.773 1.00 0.00 C ATOM 1469 C GLU A 92 0.554 -0.466 -10.874 1.00 0.00 C ATOM 1470 O GLU A 92 0.602 0.518 -10.161 1.00 0.00 O ATOM 1471 CB GLU A 92 -1.874 -0.848 -11.343 1.00 0.00 C ATOM 1472 CG GLU A 92 -3.034 -1.825 -11.162 1.00 0.00 C ATOM 1473 CD GLU A 92 -4.315 -1.228 -11.750 1.00 0.00 C ATOM 1474 OE1 GLU A 92 -4.242 -0.140 -12.295 1.00 0.00 O ATOM 1475 OE2 GLU A 92 -5.346 -1.873 -11.646 1.00 0.00 O ATOM 0 H GLU A 92 -0.988 -1.039 -8.713 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.343 -2.368 -11.339 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -2.092 0.092 -10.836 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.740 -0.616 -12.400 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.804 -2.771 -11.653 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -3.176 -2.042 -10.103 1.00 0.00 H new ATOM 1482 N LYS A 93 1.485 -0.713 -11.759 1.00 0.00 N ATOM 1483 CA LYS A 93 2.641 0.213 -11.918 1.00 0.00 C ATOM 1484 C LYS A 93 2.240 1.387 -12.809 1.00 0.00 C ATOM 1485 O LYS A 93 1.892 1.218 -13.961 1.00 0.00 O ATOM 1486 CB LYS A 93 3.807 -0.540 -12.559 1.00 0.00 C ATOM 1487 CG LYS A 93 5.026 0.380 -12.639 1.00 0.00 C ATOM 1488 CD LYS A 93 6.247 -0.412 -13.124 1.00 0.00 C ATOM 1489 CE LYS A 93 6.098 -0.761 -14.610 1.00 0.00 C ATOM 1490 NZ LYS A 93 7.424 -1.162 -15.160 1.00 0.00 N ATOM 0 H LYS A 93 1.492 -1.521 -12.381 1.00 0.00 H new ATOM 0 HA LYS A 93 2.942 0.590 -10.941 1.00 0.00 H new ATOM 0 HB2 LYS A 93 4.046 -1.428 -11.974 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.529 -0.881 -13.556 1.00 0.00 H new ATOM 0 HG2 LYS A 93 4.824 1.207 -13.320 1.00 0.00 H new ATOM 0 HG3 LYS A 93 5.229 0.815 -11.660 1.00 0.00 H new ATOM 0 HD2 LYS A 93 7.153 0.173 -12.970 1.00 0.00 H new ATOM 0 HD3 LYS A 93 6.353 -1.325 -12.538 1.00 0.00 H new ATOM 0 HE2 LYS A 93 5.380 -1.572 -14.734 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.709 0.096 -15.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 7.325 -1.399 -16.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 8.096 -0.375 -15.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 7.778 -1.992 -14.643 1.00 0.00 H new ATOM 1504 N LEU A 94 2.288 2.580 -12.273 1.00 0.00 N ATOM 1505 CA LEU A 94 1.908 3.790 -13.065 1.00 0.00 C ATOM 1506 C LEU A 94 3.153 4.643 -13.322 1.00 0.00 C ATOM 1507 O LEU A 94 3.907 4.952 -12.421 1.00 0.00 O ATOM 1508 CB LEU A 94 0.885 4.604 -12.266 1.00 0.00 C ATOM 1509 CG LEU A 94 -0.291 3.705 -11.855 1.00 0.00 C ATOM 1510 CD1 LEU A 94 -1.306 4.534 -11.063 1.00 0.00 C ATOM 1511 CD2 LEU A 94 -0.970 3.116 -13.101 1.00 0.00 C ATOM 0 H LEU A 94 2.576 2.769 -11.313 1.00 0.00 H new ATOM 0 HA LEU A 94 1.476 3.488 -14.019 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.357 5.028 -11.380 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.523 5.439 -12.866 1.00 0.00 H new ATOM 0 HG LEU A 94 0.082 2.888 -11.238 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.143 3.900 -10.769 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.828 4.940 -10.172 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.671 5.352 -11.684 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.802 2.481 -12.796 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.343 3.925 -13.729 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.248 2.524 -13.663 1.00 0.00 H new ATOM 1523 N SER A 95 3.365 5.033 -14.549 1.00 0.00 N ATOM 1524 CA SER A 95 4.547 5.878 -14.879 1.00 0.00 C ATOM 1525 C SER A 95 4.258 7.315 -14.443 1.00 0.00 C ATOM 1526 O SER A 95 4.746 8.267 -15.023 1.00 0.00 O ATOM 1527 CB SER A 95 4.786 5.834 -16.389 1.00 0.00 C ATOM 1528 OG SER A 95 4.964 4.483 -16.796 1.00 0.00 O ATOM 0 H SER A 95 2.766 4.801 -15.342 1.00 0.00 H new ATOM 0 HA SER A 95 5.433 5.509 -14.363 1.00 0.00 H new ATOM 0 HB2 SER A 95 3.941 6.277 -16.916 1.00 0.00 H new ATOM 0 HB3 SER A 95 5.666 6.423 -16.647 1.00 0.00 H new ATOM 0 HG SER A 95 5.116 4.450 -17.764 1.00 0.00 H new ATOM 1534 N GLU A 96 3.457 7.472 -13.420 1.00 0.00 N ATOM 1535 CA GLU A 96 3.106 8.834 -12.918 1.00 0.00 C ATOM 1536 C GLU A 96 3.746 9.041 -11.534 1.00 0.00 C ATOM 1537 O GLU A 96 3.171 8.670 -10.530 1.00 0.00 O ATOM 1538 CB GLU A 96 1.585 8.939 -12.791 1.00 0.00 C ATOM 1539 CG GLU A 96 1.208 10.364 -12.378 1.00 0.00 C ATOM 1540 CD GLU A 96 -0.298 10.564 -12.550 1.00 0.00 C ATOM 1541 OE1 GLU A 96 -0.989 9.575 -12.726 1.00 0.00 O ATOM 1542 OE2 GLU A 96 -0.733 11.703 -12.505 1.00 0.00 O ATOM 0 H GLU A 96 3.026 6.704 -12.905 1.00 0.00 H new ATOM 0 HA GLU A 96 3.473 9.592 -13.609 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.111 8.686 -13.739 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.220 8.226 -12.052 1.00 0.00 H new ATOM 0 HG2 GLU A 96 1.493 10.541 -11.341 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.753 11.086 -12.986 1.00 0.00 H new ATOM 1549 N PRO A 97 4.934 9.606 -11.469 1.00 0.00 N ATOM 1550 CA PRO A 97 5.639 9.828 -10.174 1.00 0.00 C ATOM 1551 C PRO A 97 5.043 10.996 -9.383 1.00 0.00 C ATOM 1552 O PRO A 97 4.498 11.929 -9.941 1.00 0.00 O ATOM 1553 CB PRO A 97 7.091 10.107 -10.590 1.00 0.00 C ATOM 1554 CG PRO A 97 6.999 10.682 -11.969 1.00 0.00 C ATOM 1555 CD PRO A 97 5.727 10.105 -12.609 1.00 0.00 C ATOM 0 HA PRO A 97 5.549 8.973 -9.504 1.00 0.00 H new ATOM 0 HB2 PRO A 97 7.570 10.805 -9.903 1.00 0.00 H new ATOM 0 HB3 PRO A 97 7.685 9.193 -10.583 1.00 0.00 H new ATOM 0 HG2 PRO A 97 6.953 11.770 -11.931 1.00 0.00 H new ATOM 0 HG3 PRO A 97 7.879 10.421 -12.556 1.00 0.00 H new ATOM 0 HD2 PRO A 97 5.183 10.867 -13.168 1.00 0.00 H new ATOM 0 HD3 PRO A 97 5.963 9.304 -13.309 1.00 0.00 H new ATOM 1563 N ILE A 98 5.141 10.942 -8.082 1.00 0.00 N ATOM 1564 CA ILE A 98 4.580 12.036 -7.235 1.00 0.00 C ATOM 1565 C ILE A 98 5.714 12.949 -6.762 1.00 0.00 C ATOM 1566 O ILE A 98 6.699 12.508 -6.202 1.00 0.00 O ATOM 1567 CB ILE A 98 3.870 11.415 -6.033 1.00 0.00 C ATOM 1568 CG1 ILE A 98 2.743 10.505 -6.535 1.00 0.00 C ATOM 1569 CG2 ILE A 98 3.278 12.521 -5.159 1.00 0.00 C ATOM 1570 CD1 ILE A 98 2.187 9.681 -5.372 1.00 0.00 C ATOM 0 H ILE A 98 5.588 10.184 -7.566 1.00 0.00 H new ATOM 0 HA ILE A 98 3.869 12.628 -7.811 1.00 0.00 H new ATOM 0 HB ILE A 98 4.582 10.835 -5.446 1.00 0.00 H new ATOM 0 HG12 ILE A 98 1.949 11.105 -6.980 1.00 0.00 H new ATOM 0 HG13 ILE A 98 3.118 9.843 -7.316 1.00 0.00 H new ATOM 0 HG21 ILE A 98 2.772 12.076 -4.302 1.00 0.00 H new ATOM 0 HG22 ILE A 98 4.077 13.175 -4.809 1.00 0.00 H new ATOM 0 HG23 ILE A 98 2.563 13.101 -5.742 1.00 0.00 H new ATOM 0 HD11 ILE A 98 1.386 9.036 -5.733 1.00 0.00 H new ATOM 0 HD12 ILE A 98 2.982 9.069 -4.947 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.796 10.351 -4.606 1.00 0.00 H new ATOM 1582 N GLU A 99 5.573 14.227 -6.995 1.00 0.00 N ATOM 1583 CA GLU A 99 6.624 15.200 -6.577 1.00 0.00 C ATOM 1584 C GLU A 99 6.369 15.659 -5.142 1.00 0.00 C ATOM 1585 O GLU A 99 5.375 16.295 -4.846 1.00 0.00 O ATOM 1586 CB GLU A 99 6.590 16.408 -7.515 1.00 0.00 C ATOM 1587 CG GLU A 99 7.170 16.013 -8.875 1.00 0.00 C ATOM 1588 CD GLU A 99 7.057 17.189 -9.850 1.00 0.00 C ATOM 1589 OE1 GLU A 99 6.538 18.218 -9.450 1.00 0.00 O ATOM 1590 OE2 GLU A 99 7.494 17.041 -10.979 1.00 0.00 O ATOM 0 H GLU A 99 4.767 14.642 -7.462 1.00 0.00 H new ATOM 0 HA GLU A 99 7.602 14.721 -6.627 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.566 16.762 -7.633 1.00 0.00 H new ATOM 0 HB3 GLU A 99 7.164 17.230 -7.088 1.00 0.00 H new ATOM 0 HG2 GLU A 99 8.214 15.720 -8.764 1.00 0.00 H new ATOM 0 HG3 GLU A 99 6.637 15.149 -9.271 1.00 0.00 H new ATOM 1597 N VAL A 100 7.269 15.338 -4.250 1.00 0.00 N ATOM 1598 CA VAL A 100 7.118 15.743 -2.818 1.00 0.00 C ATOM 1599 C VAL A 100 8.149 16.830 -2.490 1.00 0.00 C ATOM 1600 O VAL A 100 7.862 17.795 -1.807 1.00 0.00 O ATOM 1601 CB VAL A 100 7.369 14.523 -1.930 1.00 0.00 C ATOM 1602 CG1 VAL A 100 7.175 14.910 -0.464 1.00 0.00 C ATOM 1603 CG2 VAL A 100 6.386 13.407 -2.296 1.00 0.00 C ATOM 0 H VAL A 100 8.114 14.805 -4.454 1.00 0.00 H new ATOM 0 HA VAL A 100 6.113 16.128 -2.643 1.00 0.00 H new ATOM 0 HB VAL A 100 8.389 14.171 -2.083 1.00 0.00 H new ATOM 0 HG11 VAL A 100 7.354 14.041 0.169 1.00 0.00 H new ATOM 0 HG12 VAL A 100 7.877 15.701 -0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 100 6.155 15.265 -0.313 1.00 0.00 H new ATOM 0 HG21 VAL A 100 6.568 12.540 -1.662 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.365 13.758 -2.147 1.00 0.00 H new ATOM 0 HG23 VAL A 100 6.525 13.128 -3.340 1.00 0.00 H new ATOM 1613 N GLY A 101 9.354 16.671 -2.970 1.00 0.00 N ATOM 1614 CA GLY A 101 10.425 17.682 -2.696 1.00 0.00 C ATOM 1615 C GLY A 101 10.133 18.991 -3.440 1.00 0.00 C ATOM 1616 O GLY A 101 10.412 20.072 -2.956 1.00 0.00 O ATOM 0 H GLY A 101 9.647 15.880 -3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 101 10.488 17.872 -1.625 1.00 0.00 H new ATOM 0 HA3 GLY A 101 11.393 17.288 -3.007 1.00 0.00 H new ATOM 1620 N LEU A 102 9.584 18.901 -4.618 1.00 0.00 N ATOM 1621 CA LEU A 102 9.282 20.136 -5.401 1.00 0.00 C ATOM 1622 C LEU A 102 7.946 20.713 -4.924 1.00 0.00 C ATOM 1623 O LEU A 102 7.481 21.728 -5.408 1.00 0.00 O ATOM 1624 CB LEU A 102 9.192 19.787 -6.895 1.00 0.00 C ATOM 1625 CG LEU A 102 10.405 18.942 -7.308 1.00 0.00 C ATOM 1626 CD1 LEU A 102 10.311 18.594 -8.798 1.00 0.00 C ATOM 1627 CD2 LEU A 102 11.695 19.731 -7.049 1.00 0.00 C ATOM 0 H LEU A 102 9.330 18.025 -5.075 1.00 0.00 H new ATOM 0 HA LEU A 102 10.073 20.871 -5.253 1.00 0.00 H new ATOM 0 HB2 LEU A 102 8.271 19.239 -7.095 1.00 0.00 H new ATOM 0 HB3 LEU A 102 9.155 20.700 -7.489 1.00 0.00 H new ATOM 0 HG LEU A 102 10.417 18.023 -6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 102 11.174 17.994 -9.087 1.00 0.00 H new ATOM 0 HD12 LEU A 102 9.398 18.028 -8.983 1.00 0.00 H new ATOM 0 HD13 LEU A 102 10.294 19.512 -9.386 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.555 19.129 -7.343 1.00 0.00 H new ATOM 0 HD22 LEU A 102 11.681 20.652 -7.631 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.767 19.973 -5.989 1.00 0.00 H new ATOM 1639 N GLU A 103 7.323 20.068 -3.976 1.00 0.00 N ATOM 1640 CA GLU A 103 6.015 20.568 -3.465 1.00 0.00 C ATOM 1641 C GLU A 103 6.161 22.008 -2.965 1.00 0.00 C ATOM 1642 O GLU A 103 7.042 22.330 -2.190 1.00 0.00 O ATOM 1643 CB GLU A 103 5.532 19.673 -2.320 1.00 0.00 C ATOM 1644 CG GLU A 103 4.153 20.147 -1.853 1.00 0.00 C ATOM 1645 CD GLU A 103 3.609 19.201 -0.779 1.00 0.00 C ATOM 1646 OE1 GLU A 103 4.378 18.397 -0.279 1.00 0.00 O ATOM 1647 OE2 GLU A 103 2.431 19.298 -0.479 1.00 0.00 O ATOM 0 H GLU A 103 7.664 19.215 -3.533 1.00 0.00 H new ATOM 0 HA GLU A 103 5.286 20.545 -4.275 1.00 0.00 H new ATOM 0 HB2 GLU A 103 5.480 18.636 -2.651 1.00 0.00 H new ATOM 0 HB3 GLU A 103 6.241 19.708 -1.492 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.223 21.160 -1.456 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.466 20.183 -2.699 1.00 0.00 H new ATOM 1654 N HIS A 104 5.291 22.875 -3.407 1.00 0.00 N ATOM 1655 CA HIS A 104 5.348 24.301 -2.975 1.00 0.00 C ATOM 1656 C HIS A 104 4.528 24.491 -1.695 1.00 0.00 C ATOM 1657 O HIS A 104 5.053 24.503 -0.598 1.00 0.00 O ATOM 1658 CB HIS A 104 4.756 25.177 -4.079 1.00 0.00 C ATOM 1659 CG HIS A 104 4.779 26.617 -3.643 1.00 0.00 C ATOM 1660 ND1 HIS A 104 5.959 27.333 -3.535 1.00 0.00 N ATOM 1661 CD2 HIS A 104 3.777 27.487 -3.287 1.00 0.00 C ATOM 1662 CE1 HIS A 104 5.645 28.576 -3.129 1.00 0.00 C ATOM 1663 NE2 HIS A 104 4.328 28.725 -2.963 1.00 0.00 N ATOM 0 H HIS A 104 4.535 22.654 -4.056 1.00 0.00 H new ATOM 0 HA HIS A 104 6.384 24.581 -2.785 1.00 0.00 H new ATOM 0 HB2 HIS A 104 5.327 25.056 -5.000 1.00 0.00 H new ATOM 0 HB3 HIS A 104 3.733 24.867 -4.295 1.00 0.00 H new ATOM 0 HD2 HIS A 104 2.724 27.248 -3.262 1.00 0.00 H new ATOM 0 HE1 HIS A 104 6.369 29.359 -2.958 1.00 0.00 H new ATOM 0 HE2 HIS A 104 3.832 29.565 -2.663 1.00 0.00 H new ATOM 1671 N HIS A 105 3.236 24.650 -1.828 1.00 0.00 N ATOM 1672 CA HIS A 105 2.376 24.851 -0.625 1.00 0.00 C ATOM 1673 C HIS A 105 0.988 24.251 -0.863 1.00 0.00 C ATOM 1674 O HIS A 105 0.489 24.223 -1.971 1.00 0.00 O ATOM 1675 CB HIS A 105 2.240 26.345 -0.338 1.00 0.00 C ATOM 1676 CG HIS A 105 1.497 26.535 0.955 1.00 0.00 C ATOM 1677 ND1 HIS A 105 2.067 26.243 2.184 1.00 0.00 N ATOM 1678 CD2 HIS A 105 0.227 26.982 1.227 1.00 0.00 C ATOM 1679 CE1 HIS A 105 1.150 26.514 3.130 1.00 0.00 C ATOM 1680 NE2 HIS A 105 0.011 26.968 2.601 1.00 0.00 N ATOM 0 H HIS A 105 2.740 24.649 -2.719 1.00 0.00 H new ATOM 0 HA HIS A 105 2.838 24.353 0.228 1.00 0.00 H new ATOM 0 HB2 HIS A 105 3.225 26.807 -0.276 1.00 0.00 H new ATOM 0 HB3 HIS A 105 1.708 26.837 -1.152 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -0.494 27.296 0.487 1.00 0.00 H new ATOM 0 HE1 HIS A 105 1.315 26.381 4.189 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -0.836 27.245 3.098 1.00 0.00 H new ATOM 1688 N HIS A 106 0.367 23.764 0.176 1.00 0.00 N ATOM 1689 CA HIS A 106 -0.982 23.150 0.029 1.00 0.00 C ATOM 1690 C HIS A 106 -2.041 24.219 -0.256 1.00 0.00 C ATOM 1691 O HIS A 106 -2.096 25.253 0.382 1.00 0.00 O ATOM 1692 CB HIS A 106 -1.352 22.412 1.314 1.00 0.00 C ATOM 1693 CG HIS A 106 -2.707 21.788 1.142 1.00 0.00 C ATOM 1694 ND1 HIS A 106 -2.927 20.748 0.257 1.00 0.00 N ATOM 1695 CD2 HIS A 106 -3.924 22.057 1.718 1.00 0.00 C ATOM 1696 CE1 HIS A 106 -4.233 20.431 0.321 1.00 0.00 C ATOM 1697 NE2 HIS A 106 -4.887 21.199 1.197 1.00 0.00 N ATOM 0 H HIS A 106 0.739 23.765 1.126 1.00 0.00 H new ATOM 0 HA HIS A 106 -0.951 22.453 -0.809 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -0.609 21.646 1.536 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -1.359 23.103 2.157 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -4.106 22.818 2.462 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -4.696 19.651 -0.265 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -5.879 21.164 1.433 1.00 0.00 H new ATOM 1705 N HIS A 107 -2.892 23.961 -1.215 1.00 0.00 N ATOM 1706 CA HIS A 107 -3.965 24.938 -1.561 1.00 0.00 C ATOM 1707 C HIS A 107 -5.222 24.185 -2.006 1.00 0.00 C ATOM 1708 O HIS A 107 -5.154 23.165 -2.664 1.00 0.00 O ATOM 1709 CB HIS A 107 -3.488 25.846 -2.691 1.00 0.00 C ATOM 1710 CG HIS A 107 -4.496 26.942 -2.898 1.00 0.00 C ATOM 1711 ND1 HIS A 107 -5.664 26.745 -3.619 1.00 0.00 N ATOM 1712 CD2 HIS A 107 -4.530 28.247 -2.477 1.00 0.00 C ATOM 1713 CE1 HIS A 107 -6.347 27.904 -3.608 1.00 0.00 C ATOM 1714 NE2 HIS A 107 -5.700 28.854 -2.925 1.00 0.00 N ATOM 0 H HIS A 107 -2.889 23.109 -1.776 1.00 0.00 H new ATOM 0 HA HIS A 107 -4.196 25.543 -0.684 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -2.515 26.271 -2.447 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -3.363 25.271 -3.609 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -5.953 25.879 -4.075 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -3.765 28.730 -1.887 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -7.302 28.049 -4.092 1.00 0.00 H new ATOM 1722 N HIS A 108 -6.371 24.686 -1.639 1.00 0.00 N ATOM 1723 CA HIS A 108 -7.648 24.016 -2.016 1.00 0.00 C ATOM 1724 C HIS A 108 -7.909 24.165 -3.519 1.00 0.00 C ATOM 1725 O HIS A 108 -7.688 25.208 -4.105 1.00 0.00 O ATOM 1726 CB HIS A 108 -8.796 24.654 -1.230 1.00 0.00 C ATOM 1727 CG HIS A 108 -8.648 24.316 0.228 1.00 0.00 C ATOM 1728 ND1 HIS A 108 -7.944 25.124 1.109 1.00 0.00 N ATOM 1729 CD2 HIS A 108 -9.098 23.255 0.974 1.00 0.00 C ATOM 1730 CE1 HIS A 108 -7.989 24.541 2.320 1.00 0.00 C ATOM 1731 NE2 HIS A 108 -8.680 23.398 2.294 1.00 0.00 N ATOM 0 H HIS A 108 -6.480 25.538 -1.089 1.00 0.00 H new ATOM 0 HA HIS A 108 -7.578 22.954 -1.780 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -8.789 25.735 -1.367 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -9.754 24.292 -1.604 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -9.687 22.434 0.594 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -7.523 24.947 3.206 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -8.862 22.766 3.074 1.00 0.00 H new ATOM 1739 N HIS A 109 -8.382 23.120 -4.142 1.00 0.00 N ATOM 1740 CA HIS A 109 -8.666 23.175 -5.602 1.00 0.00 C ATOM 1741 C HIS A 109 -9.471 21.938 -6.000 1.00 0.00 C ATOM 1742 O HIS A 109 -9.517 21.636 -7.182 1.00 0.00 O ATOM 1743 CB HIS A 109 -7.349 23.208 -6.386 1.00 0.00 C ATOM 1744 CG HIS A 109 -6.557 21.950 -6.134 1.00 0.00 C ATOM 1745 ND1 HIS A 109 -7.018 20.924 -5.320 1.00 0.00 N ATOM 1746 CD2 HIS A 109 -5.327 21.541 -6.589 1.00 0.00 C ATOM 1747 CE1 HIS A 109 -6.077 19.959 -5.311 1.00 0.00 C ATOM 1748 NE2 HIS A 109 -5.026 20.286 -6.068 1.00 0.00 N ATOM 1749 OXT HIS A 109 -10.031 21.312 -5.115 1.00 0.00 O ATOM 0 H HIS A 109 -8.585 22.225 -3.698 1.00 0.00 H new ATOM 0 HA HIS A 109 -9.237 24.075 -5.830 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -7.555 23.309 -7.452 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -6.764 24.079 -6.091 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -4.690 22.108 -7.251 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -6.162 19.034 -4.759 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -4.183 19.734 -6.230 1.00 0.00 H new TER 1757 HIS A 109